A0A3B3TMM3_9TELE Loading...

SplA/ryanodine receptor domain and SOCS box containing 1

AlphaFold DB , UniProt , Accession A0A3B3TMM3, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 273 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.9	Very low	49.5	Very low	245 Å²	245	130.6 Å²	130.6	100%	1.207	77%	0.767	S	S	*	*				0	99.4	0	-67.3	-173	-151.7	0	0	107.6	Q3	M1-Q3 PolarHBondContact O-N 3.15Å
2	G	34.6	Very low	51.9	Low	81 Å²	81	120.4 Å²	120.4	84%	0.835	71%	0.707	S	S	*	*			trans	-79.2	110.2	176.7	0	0	0	0	0	109.2	K4	G2-K4 PolarHBondContact O-N 2.86Å
3	Q	35.6	Very low	54.1	Low	189 Å²	189	113.6 Å²	113.6	88%	0.883	67%	0.665	S	S	*	*			trans	-61.8	115.9	166.9	-81.1	176.8	-26.2	0	0	108	M1 V5	M1-Q3 PolarHBondContact O-N 3.15Å; Q3-V5 PolarHBondContact O-N 3.24Å
4	K	34.8	Very low	55.5	Low	206 Å²	206	108.4 Å²	108.4	90%	0.896	63%	0.632	S	S	*	*			trans	-65.7	111.2	163.1	-84.4	-176.5	172.8	-176.5	0	106.9	G2	G2-K4 PolarHBondContact O-N 2.86Å
5	V	36.1	Very low	56.6	Low	129 Å²	129	111.2 Å²	111.2	78%	0.782	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-61.2	128.2	165.6	-176.8	0	0	0	0	106.7	Q3 G7	Q3-V5 PolarHBondContact O-N 3.24Å; V5-G7 PolarHBondContact O-N 3.4Å
6	P	44.4	Very low	57.8	Low	116 Å²	116	108.8 Å²	108.8	75%	0.753	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-60.1	127.4	174.1	-14.6	27.4	0	0	0	108.1	G8	P6-G8 PolarHBondContact O-N 2.93Å
7	G	47.8	Very low	57.9	Low	75 Å²	75	109.9 Å²	109.9	77%	0.773	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-53.7	129.7	172.7	0	0	0	0	0	109.2	V5	V5-G7 PolarHBondContact O-N 3.4Å
8	G	56.3	Low	58.1	Low	56 Å²	56	108.2 Å²	108.2	58%	0.577	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-61.1	149.1	177.5	0	0	0	0	0	111.1	P6 K10	P6-G8 PolarHBondContact O-N 2.93Å; G8-K10 WeakPolarHBondContact O-CG 3.35Å; G8-K10 PolarHBondContact O-N 2.97Å
9	I	62.2	Low	58.3	Low	132 Å²	132	105.9 Å²	105.9	68%	0.677	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-50.8	120.4	172.2	-60.2	172.3	0	0	0	108.4
10	K	77.9	Confident	58	Low	124 Å²	124	105.3 Å²	105.3	54%	0.539	61%	0.611	S	S	.	*	P	Polyproline II helix	trans	-103.1	142	175.9	-62.3	176.5	-175.1	170	0	110.5	G8 D169 T170	G8-K10 WeakPolarHBondContact O-CG 3.35Å; G8-K10 PolarHBondContact O-N 2.97Å; K10-D169 WeakPolarHBondContact CB-OD1 3.34Å; K10-D169 PolarHBondContact N-OD1 2.91Å; K10-D169 WeakPolarHBondContact O-CA 3.39Å; K10-T170 PolarHBondContact O-N 3.01Å
11	T	77.6	Confident	57.8	Low	84 Å²	84	104.7 Å²	104.7	52%	0.515	61%	0.611	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.4	125	168.8	-52.8	0	0	0	0	107.9	T170 I172	T11-T170 CarbonylContact C-O 3.47Å; T11-T170 WeakPolarHBondContact CA-O 3.36Å; T11-I172 HydrophobicContact CG2-CD1 3.37Å; T11-I172 HydrophobicContact CG2-CG1 3.56Å
12	I	79.1	Confident	59	Low	8 Å²	8	94 Å²	94	4%	0.041	56%	0.558	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.8	120.3	-176.4	-68.1	167.2	0	0	0	108.7	F19 L22 L165 D169 T170 F171 I172	I12-F19 HydrophobicContact CG1-CE1 4.16Å; I12-F19 HydrophobicContact CG1-CZ 4.41Å; I12-L22 HydrophobicContact CB-CD1 4.49Å; I12-L22 HydrophobicContact CD1-CD1 4.27Å; I12-L22 HydrophobicContact CG1-CD1 4.33Å; I12-L22 HydrophobicContact CG2-CD1 3.37Å; I12-L165 HydrophobicContact CD1-CD2 3.45Å; I12-L165 VanDerWaalsContact CD1-CD2 3.45Å; I12-D169 HydrophobicContact CD1-CB 4.31Å; I12-T170 PolarHBondContact N-O 2.96Å; I12-F171 HydrophobicContact CB-CD2 4.39Å; I12-F171 HydrophobicContact CG2-CD2 3.9Å; I12-F171 HydrophobicContact CG2-CE2 4.32Å; I12-I172 PolarHBondContact O-N 2.84Å
13	D	80.3	Confident	60.2	Low	32 Å²	32	93.3 Å²	93.3	17%	0.171	54%	0.538	C	S	.	.			trans	-116.3	122.4	170.5	-166.8	-30.2	0	0	0	108.7	R15 D16 I172	D13-R15 PolarHBondContact O-N 2.63Å; D13-R15 VanDerWaalsContact O-N 3.13Å; D13-R15 WeakPolarHBondContact OD1-CB 3.49Å; D13-R15 IonicContact OD1-CZ 3.38Å; D13-R15 PolarHBondContact OD1-N 3.13Å; D13-R15 IonicContact OD1-NE 2.85Å; D13-R15 PolarHBondContact OD1-NE 3.33Å; D13-R15 IonicContact OD1-NH2 3.28Å; D13-R15 IonicContact OD2-CZ 3.48Å; D13-R15 IonicContact OD2-NE 3.87Å; D13-R15 PolarHBondContact OD2-NE 3.43Å; D13-R15 IonicContact OD2-NH2 2.72Å; D13-R15 PolarHBondContact OD2-NH2 3.09Å; D13-D16 HydrophobicContact CB-CB 4.5Å; D13-D16 WeakPolarHBondContact O-CB 3.31Å; D13-D16 PolarHBondContact O-N 3.48Å; D13-D16 VanDerWaalsContact O-N 3.1Å; D13-I172 HydrophobicContact CB-CB 4.27Å; D13-I172 HydrophobicContact CB-CD1 4.01Å
14	M	73.9	Confident	61.4	Low	41 Å²	41	90 Å²	90	20%	0.202	53%	0.526	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-13.3	179.6	-70.6	-164.4	-55.1	0	0	113.8	D16 L26 F171 V192 D193 H195	M14-D16 VanDerWaalsContact C-N 3.33Å; M14-L26 HydrophobicContact CG-CD1 4.3Å; M14-L26 HydrophobicContact SD-CD1 3.84Å; M14-L26 HydrophobicContact SD-CD2 4.01Å; M14-F171 HydrophobicContact CE-CZ 3.79Å; M14-F171 HydrophobicContact CG-CE2 3.51Å; M14-F171 HydrophobicContact CG-CZ 3.65Å; M14-F171 HydrophobicContact SD-CE2 3.94Å; M14-F171 HydrophobicContact SD-CZ 3.6Å; M14-F171 VanDerWaalsContact SD-CZ 3.6Å; M14-V192 HydrophobicContact CE-CB 3.98Å; M14-V192 HydrophobicContact CE-CG1 3.61Å; M14-V192 WeakPolarHBondContact CE-O 3.35Å; M14-D193 HydrophobicContact CE-CB 3.67Å; M14-D193 WeakPolarHBondContact CE-OD2 3.44Å; M14-H195 HydrophobicContact SD-CB 4.46Å
15	R	72.2	Confident	63	Low	150 Å²	150	84.6 Å²	84.6	57%	0.566	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-8.2	177.6	-59.2	167.9	-64.2	176.9	3.7	112.3	D13 P17	D13-R15 PolarHBondContact O-N 2.63Å; D13-R15 VanDerWaalsContact O-N 3.13Å; D13-R15 WeakPolarHBondContact OD1-CB 3.49Å; D13-R15 IonicContact OD1-CZ 3.38Å; D13-R15 PolarHBondContact OD1-N 3.13Å; D13-R15 IonicContact OD1-NE 2.85Å; D13-R15 PolarHBondContact OD1-NE 3.33Å; D13-R15 IonicContact OD1-NH2 3.28Å; D13-R15 IonicContact OD2-CZ 3.48Å; D13-R15 IonicContact OD2-NE 3.87Å; D13-R15 PolarHBondContact OD2-NE 3.43Å; D13-R15 IonicContact OD2-NH2 2.72Å; D13-R15 PolarHBondContact OD2-NH2 3.09Å; R15-P17 WeakPolarHBondContact O-CD 3.48Å
16	D	74.6	Confident	64.5	Low	73 Å²	73	79.2 Å²	79.2	39%	0.39	47%	0.471	S	S	.	.			trans	-77.7	117.6	177.8	-170.1	-21.1	0	0	0	110.7	D13 M14 A18 F19	D13-D16 HydrophobicContact CB-CB 4.5Å; D13-D16 WeakPolarHBondContact O-CB 3.31Å; D13-D16 PolarHBondContact O-N 3.48Å; D13-D16 VanDerWaalsContact O-N 3.1Å; M14-D16 VanDerWaalsContact C-N 3.33Å; D16-A18 PolarHBondContact O-N 3.49Å; D16-A18 VanDerWaalsContact O-N 3.12Å; D16-A18 VanDerWaalsContact OD1-CB 3.28Å; D16-A18 WeakPolarHBondContact OD1-CB 3.31Å; D16-A18 PolarHBondContact OD1-N 3.47Å; D16-F19 HydrophobicContact CB-CD2 4.03Å; D16-F19 PolarHBondContact O-N 2.98Å
17	P	60.9	Low	65.4	Low	128 Å²	128	78.4 Å²	78.4	83%	0.831	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-17.9	178.7	-18.7	30.6	0	0	0	114.4	R15 F19	R15-P17 WeakPolarHBondContact O-CD 3.48Å; P17-F19 VanDerWaalsContact C-N 3.25Å; P17-F19 PolarHBondContact O-N 3Å
18	A	61.4	Low	66.2	Low	78 Å²	78	77.5 Å²	77.5	65%	0.645	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-8.9	-175.8	0	0	0	0	0	114.2	D16 S20	D16-A18 PolarHBondContact O-N 3.49Å; D16-A18 VanDerWaalsContact O-N 3.12Å; D16-A18 VanDerWaalsContact OD1-CB 3.28Å; D16-A18 WeakPolarHBondContact OD1-CB 3.31Å; D16-A18 PolarHBondContact OD1-N 3.47Å; A18-S20 PolarHBondContact O-N 3.15Å
19	F	60.6	Low	66.7	Low	66 Å²	66	76.4 Å²	76.4	29%	0.289	42%	0.423	S	S	.	.			trans	-98.9	57.8	-174.2	-81.7	-89.9	0	0	0	114.1	I12 D16 P17 L22	I12-F19 HydrophobicContact CG1-CE1 4.16Å; I12-F19 HydrophobicContact CG1-CZ 4.41Å; D16-F19 HydrophobicContact CB-CD2 4.03Å; D16-F19 PolarHBondContact O-N 2.98Å; P17-F19 VanDerWaalsContact C-N 3.25Å; P17-F19 PolarHBondContact O-N 3Å; F19-L22 HydrophobicContact CB-CD1 4.11Å; F19-L22 HydrophobicContact CD1-CD1 3.52Å; F19-L22 HydrophobicContact CD1-CG 4.29Å; F19-L22 HydrophobicContact CE1-CD1 4.23Å; F19-L22 HydrophobicContact CG-CD1 4.08Å; F19-L22 PolarHBondContact O-N 3.05Å
20	S	53.1	Low	66.8	Low	92 Å²	92	72.8 Å²	72.8	64%	0.643	41%	0.409	S	S	*	.	H	α-helix	trans	-53.3	-39.2	172	175.7	0	0	0	0	115.2	A18 L22 T23	A18-S20 PolarHBondContact O-N 3.15Å; S20-L22 PolarHBondContact O-N 2.84Å; S20-T23 VanDerWaalsContact O-CB 3.3Å; S20-T23 WeakPolarHBondContact O-CB 3.42Å; S20-T23 PolarHBondContact O-N 3.29Å; S20-T23 PolarHBondContact O-OG1 3.22Å; S20-T23 VanDerWaalsContact O-OG1 3.1Å
21	P	53.5	Low	66.1	Low	94 Å²	94	74.6 Å²	74.6	61%	0.61	42%	0.419	S	S	*	.	H	α-helix	trans	-67	-32.1	-177.5	-20.7	33	0	0	0	115	T23	P21-T23 VanDerWaalsContact C-N 3.27Å; P21-T23 PolarHBondContact O-N 2.92Å
22	L	61.4	Low	65.8	Low	19 Å²	19	74.6 Å²	74.6	10%	0.099	42%	0.419	C	S	.	.	H	α-helix	trans	-72.1	-22.5	178.3	-75.2	169.1	0	0	0	112.3	I12 F19 S20 L24 E25 L26 F164	I12-L22 HydrophobicContact CB-CD1 4.49Å; I12-L22 HydrophobicContact CD1-CD1 4.27Å; I12-L22 HydrophobicContact CG1-CD1 4.33Å; I12-L22 HydrophobicContact CG2-CD1 3.37Å; F19-L22 HydrophobicContact CB-CD1 4.11Å; F19-L22 HydrophobicContact CD1-CD1 3.52Å; F19-L22 HydrophobicContact CD1-CG 4.29Å; F19-L22 HydrophobicContact CE1-CD1 4.23Å; F19-L22 HydrophobicContact CG-CD1 4.08Å; F19-L22 PolarHBondContact O-N 3.05Å; S20-L22 PolarHBondContact O-N 2.84Å; L22-L24 VanDerWaalsContact C-N 3.26Å; L22-L24 PolarHBondContact O-N 3.38Å; L22-E25 PolarHBondContact O-N 3.05Å; L22-L26 HydrophobicContact CB-CD1 4.45Å; L22-L26 VanDerWaalsContact O-CB 3.28Å; L22-L26 WeakPolarHBondContact O-CB 3.26Å; L22-L26 VanDerWaalsContact O-CG 3.24Å; L22-L26 WeakPolarHBondContact O-CG 3.48Å; L22-L26 PolarHBondContact O-N 3.29Å; L22-F164 HydrophobicContact CD2-CD2 3.46Å; L22-F164 VanDerWaalsContact CD2-CD2 3.46Å; L22-F164 HydrophobicContact CD2-CE2 3.78Å; L22-F164 HydrophobicContact CD2-CG 4.19Å
23	T	61.1	Low	65.8	Low	67 Å²	67	75.9 Å²	75.9	41%	0.411	42%	0.424	S	S	.	.	H	α-helix	trans	-58.1	-39.8	176.9	-46.5	0	0	0	0	111.5	S20 P21 Q27	S20-T23 VanDerWaalsContact O-CB 3.3Å; S20-T23 WeakPolarHBondContact O-CB 3.42Å; S20-T23 PolarHBondContact O-N 3.29Å; S20-T23 PolarHBondContact O-OG1 3.22Å; S20-T23 VanDerWaalsContact O-OG1 3.1Å; P21-T23 VanDerWaalsContact C-N 3.27Å; P21-T23 PolarHBondContact O-N 2.92Å; T23-Q27 WeakPolarHBondContact O-CB 3.48Å; T23-Q27 WeakPolarHBondContact O-CG 3.42Å; T23-Q27 PolarHBondContact O-N 3.02Å
24	L	61.1	Low	65.9	Low	121 Å²	121	76.6 Å²	76.6	63%	0.634	43%	0.431	S	S	*	.	H	α-helix	trans	-70.8	-38.6	-179.8	-74.5	165.6	0	0	0	112.2	L22 Q27 A28	L22-L24 VanDerWaalsContact C-N 3.26Å; L22-L24 PolarHBondContact O-N 3.38Å; L24-Q27 PolarHBondContact O-N 3.37Å; L24-A28 WeakPolarHBondContact O-CB 3.39Å; L24-A28 PolarHBondContact O-N 3.41Å
25	E	68.2	Low	66.4	Low	91 Å²	91	78 Å²	78	43%	0.425	45%	0.445	S	S	.	.	H	α-helix	trans	-74.5	-38.5	178.4	-67.2	176.4	153.9	0	0	111.7	L22 Q27 A28 L29 F164	L22-E25 PolarHBondContact O-N 3.05Å; E25-Q27 VanDerWaalsContact C-N 3.35Å; E25-A28 WeakPolarHBondContact O-CB 3.44Å; E25-A28 PolarHBondContact O-N 2.79Å; E25-L29 WeakPolarHBondContact O-CG 3.5Å; E25-L29 PolarHBondContact O-N 3Å; E25-F164 HydrophobicContact CB-CB 4.19Å; E25-F164 WeakPolarHBondContact OE2-CB 3.12Å
26	L	66.4	Low	67.1	Low	17 Å²	17	73.3 Å²	73.3	9%	0.089	43%	0.427	C	S	.	.	H	α-helix	trans	-64.3	-39.4	170.6	-72	169.8	0	0	0	111.4	M14 L22 L29 S30 F164 H195 L197	M14-L26 HydrophobicContact CG-CD1 4.3Å; M14-L26 HydrophobicContact SD-CD1 3.84Å; M14-L26 HydrophobicContact SD-CD2 4.01Å; L22-L26 HydrophobicContact CB-CD1 4.45Å; L22-L26 VanDerWaalsContact O-CB 3.28Å; L22-L26 WeakPolarHBondContact O-CB 3.26Å; L22-L26 VanDerWaalsContact O-CG 3.24Å; L22-L26 WeakPolarHBondContact O-CG 3.48Å; L22-L26 PolarHBondContact O-N 3.29Å; L26-L29 PolarHBondContact O-N 2.82Å; L26-S30 PolarHBondContact O-N 2.84Å; L26-F164 HydrophobicContact CD2-CD1 4.45Å; L26-F164 HydrophobicContact CD2-CE1 3.57Å; L26-F164 HydrophobicContact CD2-CZ 3.94Å; L26-F164 HydrophobicContact CG-CE1 4.36Å; L26-H195 HydrophobicContact CD2-CB 4.23Å; L26-L197 HydrophobicContact CD2-CD2 4.14Å
27	Q	63.3	Low	67.9	Low	98 Å²	98	69.8 Å²	69.8	46%	0.458	41%	0.408	S	S	.	.	H	α-helix	trans	-62.4	-45.8	170.4	-80.2	172.3	-7.8	0	0	111.2	T23 L24 E25 L29 S30 H31	T23-Q27 WeakPolarHBondContact O-CB 3.48Å; T23-Q27 WeakPolarHBondContact O-CG 3.42Å; T23-Q27 PolarHBondContact O-N 3.02Å; L24-Q27 PolarHBondContact O-N 3.37Å; E25-Q27 VanDerWaalsContact C-N 3.35Å; Q27-L29 VanDerWaalsContact C-N 3.3Å; Q27-L29 PolarHBondContact O-N 2.85Å; Q27-S30 WeakPolarHBondContact O-CA 3.17Å; Q27-S30 WeakPolarHBondContact O-CB 3.24Å; Q27-S30 PolarHBondContact O-N 3Å; Q27-S30 PolarHBondContact O-OG 2.87Å; Q27-H31 PolarHBondContact O-CD2 3.38Å; Q27-H31 PolarHBondContact O-N 2.69Å; Q27-H31 VanDerWaalsContact O-N 3.12Å
28	A	64.8	Low	69.2	Low	57 Å²	57	65.9 Å²	65.9	47%	0.471	38%	0.38	S	S	.	.	H	α-helix	trans	-58.3	-42.5	176.5	0	0	0	0	0	111.7	L24 E25 H31 T32	L24-A28 WeakPolarHBondContact O-CB 3.39Å; L24-A28 PolarHBondContact O-N 3.41Å; E25-A28 WeakPolarHBondContact O-CB 3.44Å; E25-A28 PolarHBondContact O-N 2.79Å; A28-H31 WeakPolarHBondContact O-CB 3.46Å; A28-H31 PolarHBondContact O-N 2.92Å; A28-T32 PolarHBondContact O-N 2.86Å
29	L	68.3	Low	70.4	Confident	33 Å²	33	62.3 Å²	62.3	17%	0.173	35%	0.35	C	S	.	.	H	α-helix	trans	-67.4	-34	174.1	-71.1	174	0	0	0	112.7	E25 L26 Q27 H31 T32 K33 F164 Y196	E25-L29 WeakPolarHBondContact O-CG 3.5Å; E25-L29 PolarHBondContact O-N 3Å; L26-L29 PolarHBondContact O-N 2.82Å; Q27-L29 VanDerWaalsContact C-N 3.3Å; Q27-L29 PolarHBondContact O-N 2.85Å; L29-H31 PolarHBondContact O-N 3.36Å; L29-T32 WeakPolarHBondContact O-CA 3.49Å; L29-T32 PolarHBondContact O-N 2.69Å; L29-T32 PolarHBondContact O-OG1 3.02Å; L29-K33 PolarHBondContact O-N 2.91Å; L29-F164 HydrophobicContact CD1-CD1 3.59Å; L29-F164 HydrophobicContact CD1-CE1 3.9Å; L29-Y196 WeakPolarHBondContact CB-O 3.39Å
30	S	63.2	Low	71.9	Confident	56 Å²	56	59.2 Å²	59.2	39%	0.392	34%	0.337	S	S	.	.	H	α-helix	trans	-60.3	-34.2	173.1	83.7	0	0	0	0	112.2	L26 Q27 T32 K33	L26-S30 PolarHBondContact O-N 2.84Å; Q27-S30 WeakPolarHBondContact O-CA 3.17Å; Q27-S30 WeakPolarHBondContact O-CB 3.24Å; Q27-S30 PolarHBondContact O-N 3Å; Q27-S30 PolarHBondContact O-OG 2.87Å; S30-T32 PolarHBondContact O-N 3.13Å; S30-K33 WeakPolarHBondContact O-CB 3.19Å; S30-K33 PolarHBondContact O-N 3.04Å; S30-K33 VanDerWaalsContact O-N 3.17Å
31	H	62.4	Low	73.7	Confident	161 Å²	161	56.8 Å²	56.8	75%	0.745	32%	0.316	S	S	*	.	H	α-helix	trans	-69.8	-19.2	173.8	-68.7	-73.7	0	0	0	113.4	Q27 A28 L29 K33	Q27-H31 PolarHBondContact O-CD2 3.38Å; Q27-H31 PolarHBondContact O-N 2.69Å; Q27-H31 VanDerWaalsContact O-N 3.12Å; A28-H31 WeakPolarHBondContact O-CB 3.46Å; A28-H31 PolarHBondContact O-N 2.92Å; L29-H31 PolarHBondContact O-N 3.36Å; H31-K33 VanDerWaalsContact C-N 3.34Å
32	T	71.4	Confident	75.3	Confident	84 Å²	84	53.8 Å²	53.8	52%	0.515	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-2.4	174.6	71.8	0	0	0	0	113.3	A28 L29 S30 P34	A28-T32 PolarHBondContact O-N 2.86Å; L29-T32 WeakPolarHBondContact O-CA 3.49Å; L29-T32 PolarHBondContact O-N 2.69Å; L29-T32 PolarHBondContact O-OG1 3.02Å; S30-T32 PolarHBondContact O-N 3.13Å; T32-P34 WeakPolarHBondContact O-CD 3.2Å
33	K	80.2	Confident	76.6	Confident	35 Å²	35	55.4 Å²	55.4	15%	0.152	30%	0.303	C	S	.	.	S	Bend	trans	-63.1	125	179.3	-167.9	179	176.9	-170.4	0	110.2	L29 S30 H31 S35 L37 D38 Y196	L29-K33 PolarHBondContact O-N 2.91Å; S30-K33 WeakPolarHBondContact O-CB 3.19Å; S30-K33 PolarHBondContact O-N 3.04Å; S30-K33 VanDerWaalsContact O-N 3.17Å; H31-K33 VanDerWaalsContact C-N 3.34Å; K33-S35 PolarHBondContact O-N 3.28Å; K33-L37 HydrophobicContact CD-CD2 4.42Å; K33-L37 HydrophobicContact CG-CD2 3.83Å; K33-L37 HydrophobicContact CG-CG 4.38Å; K33-D38 WeakPolarHBondContact CD-OD1 3.36Å; K33-D38 WeakPolarHBondContact CE-OD1 3.32Å; K33-D38 IonicContact NZ-OD1 3.58Å; K33-D38 PolarHBondContact NZ-OD1 2.98Å; K33-Y196 HydrophobicContact CB-CD1 4.03Å; K33-Y196 HydrophobicContact CB-CG 4.41Å; K33-Y196 HydrophobicContact CG-CD1 4.16Å; K33-Y196 HydrophobicContact CG-CG 4.13Å
34	P	83.1	Confident	78	Confident	47 Å²	47	55.4 Å²	55.4	31%	0.305	30%	0.304	S	S	.	.			trans	-60.1	136.6	179.7	-25.7	34.5	0	0	0	111.9	T32 R36 L37 D38	T32-P34 WeakPolarHBondContact O-CD 3.2Å; P34-R36 PolarHBondContact O-N 2.92Å; P34-L37 HydrophobicContact CB-CB 4.23Å; P34-L37 VanDerWaalsContact O-CB 3.27Å; P34-L37 WeakPolarHBondContact O-CB 3.48Å; P34-L37 PolarHBondContact O-N 3.39Å; P34-D38 PolarHBondContact O-N 3.45Å
35	S	82.9	Confident	79.5	Confident	70 Å²	70	53.4 Å²	53.4	49%	0.49	30%	0.299	S	S	.	.	H	α-helix	trans	-62.4	-31.1	-177	76	0	0	0	0	112.7	K33 L37 L39 R243	K33-S35 PolarHBondContact O-N 3.28Å; S35-L37 VanDerWaalsContact C-N 3.31Å; S35-L39 PolarHBondContact O-N 3.26Å; S35-R243 PolarHBondContact O-NH1 3.14Å; S35-R243 PolarHBondContact O-NH2 2.93Å
36	R	87.9	Confident	80.8	Confident	52 Å²	52	49.7 Å²	49.7	20%	0.196	28%	0.283	C	S	.	.	H	α-helix	trans	-64.8	-33.4	173	-70	174.6	61.5	107.8	4.3	112.3	P34 L39 L40 L97 D184 L230 D231 P232 E233	P34-R36 PolarHBondContact O-N 2.92Å; R36-L39 PolarHBondContact O-N 3.3Å; R36-L40 WeakPolarHBondContact O-CB 3.37Å; R36-L40 PolarHBondContact O-N 3.37Å; R36-L97 HydrophobicContact CB-CD2 4.02Å; R36-D184 IonicContact NH2-OD2 3.68Å; R36-L230 HydrophobicContact CB-CD1 4.42Å; R36-L230 WeakPolarHBondContact O-CD1 3.44Å; R36-D231 PolarHBondContact NH2-O 2.79Å; R36-P232 PolarHBondContact NH1-O 3.17Å; R36-E233 PolarHBondContact NH1-O 2.85Å
37	L	91.3	Very high	82.3	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-69.9	-40.6	178.9	177.8	60.4	0	0	0	112	K33 P34 S35 L39 L40 L41 L97 V99 V180 I191 Y196	K33-L37 HydrophobicContact CD-CD2 4.42Å; K33-L37 HydrophobicContact CG-CD2 3.83Å; K33-L37 HydrophobicContact CG-CG 4.38Å; P34-L37 HydrophobicContact CB-CB 4.23Å; P34-L37 VanDerWaalsContact O-CB 3.27Å; P34-L37 WeakPolarHBondContact O-CB 3.48Å; P34-L37 PolarHBondContact O-N 3.39Å; S35-L37 VanDerWaalsContact C-N 3.31Å; L37-L39 VanDerWaalsContact C-N 3.33Å; L37-L39 PolarHBondContact O-N 3.06Å; L37-L40 PolarHBondContact O-N 3.19Å; L37-L41 HydrophobicContact CD1-CD1 3.87Å; L37-L41 HydrophobicContact CD1-CG 4.07Å; L37-L41 HydrophobicContact CG-CD1 3.93Å; L37-L41 WeakPolarHBondContact O-CB 3.5Å; L37-L41 VanDerWaalsContact O-CG 3.24Å; L37-L41 WeakPolarHBondContact O-CG 3.38Å; L37-L41 PolarHBondContact O-N 3.11Å; L37-L97 HydrophobicContact CB-CD2 4.18Å; L37-L97 HydrophobicContact CD1-CD2 4.48Å; L37-V99 HydrophobicContact CD1-CG2 3.62Å; L37-V180 HydrophobicContact CD1-CB 4.49Å; L37-V180 HydrophobicContact CD1-CG1 3.72Å; L37-V180 HydrophobicContact CD1-CG2 3.91Å; L37-V180 HydrophobicContact CD2-CG1 4Å; L37-V180 HydrophobicContact CD2-CG2 4.1Å; L37-V180 HydrophobicContact CG-CG1 4.43Å; L37-I191 HydrophobicContact CD1-CD1 4.41Å; L37-I191 HydrophobicContact CD2-CD1 4.19Å; L37-Y196 HydrophobicContact CD2-CD2 3.97Å; L37-Y196 HydrophobicContact CD2-CE2 4.13Å; L37-Y196 HydrophobicContact CD2-CG 4.42Å
38	D	87.1	Confident	83.9	Confident	46 Å²	46	52.2 Å²	52.2	25%	0.246	30%	0.304	C	S	.	.	H	α-helix	trans	-59.4	-46	173.1	-78.8	-34.2	0	0	0	112.1	K33 P34 L40 L41 D42 R243	K33-D38 WeakPolarHBondContact CD-OD1 3.36Å; K33-D38 WeakPolarHBondContact CE-OD1 3.32Å; K33-D38 IonicContact NZ-OD1 3.58Å; K33-D38 PolarHBondContact NZ-OD1 2.98Å; P34-D38 PolarHBondContact O-N 3.45Å; D38-L40 PolarHBondContact O-N 3.07Å; D38-L41 PolarHBondContact O-N 3.31Å; D38-D42 WeakPolarHBondContact O-CB 3.21Å; D38-D42 PolarHBondContact O-N 3.42Å; D38-R243 IonicContact OD2-NH2 3.74Å
39	L	86.7	Confident	85.5	Confident	3 Å²	3	54.8 Å²	54.8	2%	0.016	31%	0.31	C	S	.	.	H	α-helix	trans	-59.5	-48.8	178.3	-179.7	69.7	0	0	0	111.4	S35 R36 L37 L41 D42 M43 L230 L235 R243	S35-L39 PolarHBondContact O-N 3.26Å; R36-L39 PolarHBondContact O-N 3.3Å; L37-L39 VanDerWaalsContact C-N 3.33Å; L37-L39 PolarHBondContact O-N 3.06Å; L39-L41 VanDerWaalsContact C-N 3.28Å; L39-L41 PolarHBondContact O-N 3.33Å; L39-D42 PolarHBondContact O-N 2.93Å; L39-D42 VanDerWaalsContact O-N 3.16Å; L39-M43 WeakPolarHBondContact O-CG 3.27Å; L39-M43 PolarHBondContact O-N 3.21Å; L39-L230 HydrophobicContact CD2-CD1 4.35Å; L39-L235 HydrophobicContact CD2-CD1 3.27Å; L39-L235 HydrophobicContact CD2-CD2 3.4Å; L39-L235 HydrophobicContact CD2-CG 3.9Å; L39-R243 HydrophobicContact CD1-CB 4.03Å; L39-R243 HydrophobicContact CD1-CG 4.37Å
40	L	92.2	Very high	86.9	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-56.9	-43.3	-179.9	-173.5	159.9	0	0	0	111.5	R36 L37 D38 D42 M43 L97 V99 N228 L230	R36-L40 WeakPolarHBondContact O-CB 3.37Å; R36-L40 PolarHBondContact O-N 3.37Å; L37-L40 PolarHBondContact O-N 3.19Å; D38-L40 PolarHBondContact O-N 3.07Å; L40-D42 VanDerWaalsContact C-N 3.33Å; L40-M43 WeakPolarHBondContact O-CB 3.46Å; L40-M43 PolarHBondContact O-N 3.39Å; L40-L97 HydrophobicContact CB-CD2 4.42Å; L40-L97 HydrophobicContact CD1-CB 4.33Å; L40-L97 HydrophobicContact CD1-CD2 3.79Å; L40-L97 HydrophobicContact CD1-CG 3.75Å; L40-V99 HydrophobicContact CD1-CG2 4.03Å; L40-V99 HydrophobicContact CD2-CB 3.79Å; L40-V99 HydrophobicContact CD2-CG2 3.6Å; L40-V99 HydrophobicContact CG-CG2 4.47Å; L40-N228 HydrophobicContact CD2-CB 3.58Å; L40-N228 HydrophobicContact CG-CB 3.84Å; L40-L230 HydrophobicContact CB-CD1 3.76Å; L40-L230 HydrophobicContact CB-CG 4.03Å; L40-L230 HydrophobicContact CD1-CB 4.4Å; L40-L230 HydrophobicContact CD1-CD1 4.38Å; L40-L230 HydrophobicContact CD1-CG 4.02Å; L40-L230 HydrophobicContact CG-CD1 4.45Å; L40-L230 HydrophobicContact CG-CG 4.2Å
41	L	91.6	Very high	88.6	Confident	41 Å²	41	53.7 Å²	53.7	22%	0.215	30%	0.301	C	S	.	.	H	α-helix	trans	-74	-22.9	-178.9	-67.3	170.6	0	0	0	113.5	L37 D38 L39 M43 V99 L178 I191 I227	L37-L41 HydrophobicContact CD1-CD1 3.87Å; L37-L41 HydrophobicContact CD1-CG 4.07Å; L37-L41 HydrophobicContact CG-CD1 3.93Å; L37-L41 WeakPolarHBondContact O-CB 3.5Å; L37-L41 VanDerWaalsContact O-CG 3.24Å; L37-L41 WeakPolarHBondContact O-CG 3.38Å; L37-L41 PolarHBondContact O-N 3.11Å; D38-L41 PolarHBondContact O-N 3.31Å; L39-L41 VanDerWaalsContact C-N 3.28Å; L39-L41 PolarHBondContact O-N 3.33Å; L41-M43 VanDerWaalsContact C-N 3.35Å; L41-V99 HydrophobicContact CD2-CG1 4.13Å; L41-L178 HydrophobicContact CD2-CD1 3.92Å; L41-I191 HydrophobicContact CD1-CD1 3.63Å; L41-I227 HydrophobicContact CD2-CG2 4.46Å
42	D	87.7	Confident	90.3	Very high	32 Å²	32	48.9 Å²	48.9	17%	0.171	28%	0.28	C	S	.	.	H	α-helix	trans	-84.1	-10.6	175.2	-78.7	-8.1	0	0	0	112.8	D38 L39 L40 R251 Y272	D38-D42 WeakPolarHBondContact O-CB 3.21Å; D38-D42 PolarHBondContact O-N 3.42Å; L39-D42 PolarHBondContact O-N 2.93Å; L39-D42 VanDerWaalsContact O-N 3.16Å; L40-D42 VanDerWaalsContact C-N 3.33Å; D42-R251 IonicContact OD1-CZ 3.51Å; D42-R251 IonicContact OD1-NE 2.75Å; D42-R251 IonicContact OD1-NH2 3.7Å; D42-R251 PolarHBondContact OD1-NH2 2.93Å; D42-Y272 VanDerWaalsContact O-CE2 3.26Å; D42-Y272 WeakPolarHBondContact O-CE2 3.49Å
43	M	88.6	Confident	91.6	Very high	52 Å²	52	50.6 Å²	50.6	26%	0.256	28%	0.282	S	S	.	.	S	Bend	trans	-74	150.7	172.7	-68.3	169.2	66.5	0	0	111	L39 L40 L41 L230 Y272	L39-M43 WeakPolarHBondContact O-CG 3.27Å; L39-M43 PolarHBondContact O-N 3.21Å; L40-M43 WeakPolarHBondContact O-CB 3.46Å; L40-M43 PolarHBondContact O-N 3.39Å; L41-M43 VanDerWaalsContact C-N 3.35Å; M43-L230 HydrophobicContact SD-CD2 3.81Å; M43-Y272 HydrophobicContact CB-CE1 4.42Å; M43-Y272 HydrophobicContact CG-CE1 4.03Å
44	P	90.1	Very high	92.5	Very high	67 Å²	67	50.2 Å²	50.2	44%	0.435	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-54	136.4	169.9	-23.3	32.8	0	0	0	110.4	N228 Y272	P44-N228 PolarHBondContact O-ND2 2.79Å; P44-Y272 VanDerWaalsContact CD-CD1 3.41Å; P44-Y272 VanDerWaalsContact CD-CG 3.46Å; P44-Y272 VanDerWaalsContact CG-CB 3.44Å; P44-Y272 HydrophobicContact CG-CD1 3.93Å; P44-Y272 HydrophobicContact CG-CD2 4.23Å; P44-Y272 HydrophobicContact CG-CG 3.66Å
45	P	91.9	Very high	93.2	Very high	80 Å²	80	48 Å²	48	52%	0.519	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-57	149.5	177.9	-23.5	32.8	0	0	0	112.1
46	A	96.1	Very high	94	Very high	12 Å²	12	44.7 Å²	44.7	10%	0.099	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-52.8	146.4	174.4	0	0	0	0	0	111.7	T50 Q51 Y226 I227 N228	A46-T50 HydrophobicContact CB-CG2 3.92Å; A46-Q51 PolarHBondContact O-NE2 3.43Å; A46-Y226 HydrophobicContact CB-CD1 3.96Å; A46-Y226 HydrophobicContact CB-CE1 4.49Å; A46-I227 WeakPolarHBondContact CB-O 3.32Å; A46-I227 PolarHBondContact N-O 3.38Å; A46-N228 PolarHBondContact N-OD1 3.42Å
47	S	97.6	Very high	94.5	Very high	63 Å²	63	43.7 Å²	43.7	44%	0.441	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-60.7	161.5	177.8	67.8	0	0	0	0	111.9	D49 T50 Q51	S47-D49 VanDerWaalsContact C-N 3.27Å; S47-D49 PolarHBondContact O-N 3.22Å; S47-T50 PolarHBondContact O-N 2.93Å; S47-T50 PolarHBondContact OG-N 3.38Å; S47-T50 PolarHBondContact OG-OG1 3.45Å; S47-Q51 WeakPolarHBondContact O-CG 3.33Å; S47-Q51 PolarHBondContact O-N 3.19Å
48	L	97.4	Very high	94.8	Very high	105 Å²	105	46.2 Å²	46.2	55%	0.55	26%	0.255	S	S	.	.	H	α-helix	trans	-58.2	-39.7	178	179.8	60.3	0	0	0	112.2	T50 Q51 I52 L73	L48-T50 VanDerWaalsContact C-N 3.35Å; L48-T50 PolarHBondContact O-N 3.02Å; L48-Q51 WeakPolarHBondContact O-CB 3.41Å; L48-Q51 PolarHBondContact O-N 3.37Å; L48-Q51 VanDerWaalsContact O-N 3.17Å; L48-I52 HydrophobicContact CD1-CD1 4.18Å; L48-I52 HydrophobicContact CD1-CG1 4.29Å; L48-I52 HydrophobicContact CG-CD1 3.99Å; L48-I52 WeakPolarHBondContact O-CG1 3.5Å; L48-I52 PolarHBondContact O-N 3.11Å; L48-L73 HydrophobicContact CD1-CD1 4.35Å
49	D	97.9	Very high	95.4	Very high	112 Å²	112	51 Å²	51	60%	0.599	28%	0.281	S	S	*	.	H	α-helix	trans	-60.7	-45.1	177.8	-62.6	-42.5	0	0	0	111.4	S47 I52 Q53	S47-D49 VanDerWaalsContact C-N 3.27Å; S47-D49 PolarHBondContact O-N 3.22Å; D49-I52 PolarHBondContact O-N 3.31Å; D49-Q53 WeakPolarHBondContact O-CG 3.35Å; D49-Q53 PolarHBondContact O-N 2.85Å
50	T	98.1	Very high	95.9	Very high	41 Å²	41	52.6 Å²	52.6	25%	0.252	29%	0.29	S	S	.	.	H	α-helix	trans	-64.2	-40.8	174.5	-57.1	0	0	0	0	111.2	A46 S47 L48 I52 Q53 H54 Y226	A46-T50 HydrophobicContact CB-CG2 3.92Å; S47-T50 PolarHBondContact O-N 2.93Å; S47-T50 PolarHBondContact OG-N 3.38Å; S47-T50 PolarHBondContact OG-OG1 3.45Å; L48-T50 VanDerWaalsContact C-N 3.35Å; L48-T50 PolarHBondContact O-N 3.02Å; T50-I52 VanDerWaalsContact C-N 3.28Å; T50-I52 PolarHBondContact O-N 2.79Å; T50-Q53 PolarHBondContact O-N 3.13Å; T50-H54 PolarHBondContact O-CD2 2.96Å; T50-H54 PolarHBondContact O-N 3.3Å; T50-H54 VanDerWaalsContact O-N 3.08Å; T50-Y226 HydrophobicContact CG2-CD1 4.07Å; T50-Y226 HydrophobicContact CG2-CE1 4.29Å
51	Q	98.6	Very high	96.2	Very high	24 Å²	24	56 Å²	56	11%	0.112	30%	0.302	C	S	.	.	H	α-helix	trans	-59	-40.6	175.4	-69.1	171.7	25.4	0	0	112	A46 S47 L48 H54 S55 L73 R225 Y226	A46-Q51 PolarHBondContact O-NE2 3.43Å; S47-Q51 WeakPolarHBondContact O-CG 3.33Å; S47-Q51 PolarHBondContact O-N 3.19Å; L48-Q51 WeakPolarHBondContact O-CB 3.41Å; L48-Q51 PolarHBondContact O-N 3.37Å; L48-Q51 VanDerWaalsContact O-N 3.17Å; Q51-H54 CarbonylContact O-C 3.58Å; Q51-H54 PolarHBondContact O-N 3.47Å; Q51-S55 WeakPolarHBondContact O-CB 3.49Å; Q51-S55 PolarHBondContact O-N 3.5Å; Q51-S55 VanDerWaalsContact O-N 3.1Å; Q51-L73 HydrophobicContact CB-CD2 4.15Å; Q51-L73 WeakPolarHBondContact O-CD2 3.04Å; Q51-R225 HydrophobicContact CG-CG 4.17Å; Q51-Y226 WeakPolarHBondContact CG-O 2.89Å
52	I	98.4	Very high	96.6	Very high	61 Å²	61	54.3 Å²	54.3	31%	0.313	29%	0.294	S	S	.	.	H	α-helix	trans	-68.8	-40	177	-68.2	168.1	0	0	0	111.2	L48 D49 T50 H54 S55 K72 L73	L48-I52 HydrophobicContact CD1-CD1 4.18Å; L48-I52 HydrophobicContact CD1-CG1 4.29Å; L48-I52 HydrophobicContact CG-CD1 3.99Å; L48-I52 WeakPolarHBondContact O-CG1 3.5Å; L48-I52 PolarHBondContact O-N 3.11Å; D49-I52 PolarHBondContact O-N 3.31Å; T50-I52 VanDerWaalsContact C-N 3.28Å; T50-I52 PolarHBondContact O-N 2.79Å; I52-H54 PolarHBondContact O-N 2.97Å; I52-S55 WeakPolarHBondContact O-CB 3.48Å; I52-S55 PolarHBondContact O-N 3.34Å; I52-S55 VanDerWaalsContact O-N 3.12Å; I52-S55 PolarHBondContact O-OG 2.83Å; I52-S55 VanDerWaalsContact O-OG 3.05Å; I52-K72 HydrophobicContact CG2-CB 4.41Å; I52-L73 HydrophobicContact CG1-CD2 4.09Å
53	Q	98.4	Very high	97.1	Very high	119 Å²	119	60 Å²	60	56%	0.556	32%	0.323	S	S	*	.	H	α-helix	trans	-60.3	-34.8	175.9	-72.5	172.1	9.9	0	0	112.3	D49 T50 R90	D49-Q53 WeakPolarHBondContact O-CG 3.35Å; D49-Q53 PolarHBondContact O-N 2.85Å; T50-Q53 PolarHBondContact O-N 3.13Å; Q53-R90 WeakPolarHBondContact O-CB 3.3Å
54	H	98.7	Very high	97.6	Very high	28 Å²	28	59.3 Å²	59.3	13%	0.13	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	8	178.6	-71	-108.8	0	0	0	113.6	T50 Q51 I52 Y93 Y226	T50-H54 PolarHBondContact O-CD2 2.96Å; T50-H54 PolarHBondContact O-N 3.3Å; T50-H54 VanDerWaalsContact O-N 3.08Å; Q51-H54 CarbonylContact O-C 3.58Å; Q51-H54 PolarHBondContact O-N 3.47Å; I52-H54 PolarHBondContact O-N 2.97Å; H54-Y93 AromaticContact CE1-CE1 3.74Å; H54-Y93 AromaticContact ND1-CE1 3.58Å; H54-Y93 AromaticContact ND1-CZ 3.63Å; H54-Y93 PolarHBondContact ND1-OH 3.1Å; H54-Y226 HydrophobicContact CB-CD1 4.41Å; H54-Y226 HydrophobicContact CB-CD2 4.01Å; H54-Y226 HydrophobicContact CB-CG 3.78Å; H54-Y226 AromaticContact CE1-CZ 3.81Å; H54-Y226 AromaticContact CG-CD2 3.97Å; H54-Y226 AromaticContact CG-CG 3.83Å; H54-Y226 AromaticContact ND1-CD2 3.69Å; H54-Y226 AromaticContact ND1-CE2 3.62Å; H54-Y226 AromaticContact ND1-CG 3.98Å; H54-Y226 AromaticContact ND1-CZ 3.84Å
55	S	98.6	Very high	98	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.007	30%	0.3	C	S	.	.	S	Bend	trans	-77.3	-173.3	-175.8	86.1	0	0	0	0	113.1	Q51 I52 K72 G89 R90	Q51-S55 WeakPolarHBondContact O-CB 3.49Å; Q51-S55 PolarHBondContact O-N 3.5Å; Q51-S55 VanDerWaalsContact O-N 3.1Å; I52-S55 WeakPolarHBondContact O-CB 3.48Å; I52-S55 PolarHBondContact O-N 3.34Å; I52-S55 VanDerWaalsContact O-N 3.12Å; I52-S55 PolarHBondContact O-OG 2.83Å; I52-S55 VanDerWaalsContact O-OG 3.05Å; S55-K72 VanDerWaalsContact CB-O 3.3Å; S55-K72 WeakPolarHBondContact CB-O 3.24Å; S55-K72 PolarHBondContact OG-O 2.85Å; S55-G89 CarbonylContact O-C 3.55Å; S55-G89 WeakPolarHBondContact O-CA 3.44Å; S55-R90 WeakPolarHBondContact O-CG 3.4Å; S55-R90 PolarHBondContact O-N 3.19Å
56	W	98.9	Very high	98.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	140.6	174.7	-60.4	126.1	0	0	0	112.6	V67 L73 F75 I87 R90 I102 V213 I222 I224	W56-V67 HydrophobicContact CB-CG2 3.72Å; W56-L73 PolarHBondContact NE1-O 3.31Å; W56-F75 AromaticContact CD1-CD1 3.65Å; W56-F75 AromaticContact CD2-CD1 3.98Å; W56-F75 HydrophobicContact CD2-CD1 3.98Å; W56-F75 HydrophobicContact CD2-CE1 4.4Å; W56-F75 AromaticContact CE2-CD1 3.66Å; W56-F75 AromaticContact CE2-CE1 3.9Å; W56-F75 AromaticContact CG-CD1 3.97Å; W56-F75 HydrophobicContact CG-CD1 3.97Å; W56-F75 HydrophobicContact CZ2-CD1 4.28Å; W56-F75 HydrophobicContact CZ2-CE1 4.05Å; W56-F75 AromaticContact NE1-CD1 3.43Å; W56-I87 HydrophobicContact CB-CD1 3.82Å; W56-I87 HydrophobicContact CB-CG1 4.28Å; W56-I87 HydrophobicContact CD2-CG2 4.27Å; W56-I87 HydrophobicContact CE3-CG1 4.34Å; W56-I87 HydrophobicContact CE3-CG2 4.06Å; W56-I87 HydrophobicContact CG-CD1 4.41Å; W56-I87 HydrophobicContact CZ3-CG2 4.44Å; W56-R90 PolarHBondContact O-NE 3.44Å; W56-I102 HydrophobicContact CH2-CD1 3.83Å; W56-I102 HydrophobicContact CZ2-CD1 3.76Å; W56-V213 HydrophobicContact CH2-CG1 3.86Å; W56-V213 HydrophobicContact CH2-CG2 3.98Å; W56-V213 HydrophobicContact CZ2-CG1 4.39Å; W56-V213 HydrophobicContact CZ2-CG2 4.24Å; W56-I222 HydrophobicContact CZ2-CG2 4.13Å; W56-I222 PolarHBondContact NE1-O 3.22Å; W56-I222 VanDerWaalsContact NE1-O 3.08Å; W56-I224 HydrophobicContact CD2-CB 4.18Å; W56-I224 HydrophobicContact CD2-CG2 3.7Å; W56-I224 VanDerWaalsContact CE2-CG2 3.48Å; W56-I224 HydrophobicContact CE3-CD1 4.45Å; W56-I224 HydrophobicContact CE3-CG2 4.44Å; W56-I224 HydrophobicContact CG-CG2 3.79Å; W56-I224 HydrophobicContact CH2-CB 4.19Å; W56-I224 HydrophobicContact CH2-CD1 3.94Å; W56-I224 HydrophobicContact CZ2-CB 3.58Å; W56-I224 HydrophobicContact CZ2-CD1 4.22Å; W56-I224 HydrophobicContact CZ2-CG1 4.38Å; W56-I224 HydrophobicContact CZ2-CG2 4.06Å; W56-I224 HydrophobicContact CZ3-CD1 4.08Å
57	N	98.7	Very high	98.4	Very high	30 Å²	30	55.4 Å²	55.4	16%	0.16	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	110.7	177.7	-169.6	-4.5	0	0	0	110.3	D59 D60 R88 R90	N57-D59 PolarHBondContact O-N 2.91Å; N57-D59 PolarHBondContact OD1-N 2.8Å; N57-D60 HydrophobicContact CB-CB 3.94Å; N57-D60 VanDerWaalsContact ND2-CB 3.32Å; N57-D60 WeakPolarHBondContact ND2-CB 3.46Å; N57-D60 PolarHBondContact O-N 2.9Å; N57-R88 WeakPolarHBondContact CB-O 3.37Å; N57-R88 PolarHBondContact N-O 3.04Å; N57-R90 HydrophobicContact CB-CG 3.8Å
58	N	98.1	Very high	98.5	Very high	53 Å²	53	54.3 Å²	54.3	28%	0.283	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	-13	-179.7	-159.3	49.6	0	0	0	113.2	R61 V67	N58-R61 WeakPolarHBondContact O-CD 3.11Å; N58-R61 PolarHBondContact O-NE 3.17Å; N58-R61 PolarHBondContact OD1-NE 2.8Å; N58-R61 VanDerWaalsContact OD1-NE 3.16Å; N58-V67 HydrophobicContact CB-CB 4.07Å; N58-V67 HydrophobicContact CB-CG2 3.81Å; N58-V67 PolarHBondContact OD1-N 3.1Å
59	D	98.4	Very high	98.4	Very high	147 Å²	147	55.8 Å²	55.8	79%	0.786	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	-6	177.7	-54.6	-42.1	0	0	0	112.2	N57	N57-D59 PolarHBondContact O-N 2.91Å; N57-D59 PolarHBondContact OD1-N 2.8Å
60	D	98.7	Very high	98.4	Very high	37 Å²	37	56.7 Å²	56.7	20%	0.198	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	73.9	-176.5	-170.8	21.1	0	0	0	111.2	N57 R88 L124	N57-D60 HydrophobicContact CB-CB 3.94Å; N57-D60 VanDerWaalsContact ND2-CB 3.32Å; N57-D60 WeakPolarHBondContact ND2-CB 3.46Å; N57-D60 PolarHBondContact O-N 2.9Å; D60-R88 PolarHBondContact O-N 3.36Å; D60-R88 VanDerWaalsContact O-N 3.16Å; D60-R88 IonicContact OD1-CZ 3.87Å; D60-R88 IonicContact OD1-NE 3.8Å; D60-R88 PolarHBondContact OD1-NE 2.81Å; D60-R88 IonicContact OD1-NH2 3.47Å; D60-R88 PolarHBondContact OD1-NH2 3.26Å; D60-R88 IonicContact OD2-CZ 2.69Å; D60-R88 IonicContact OD2-NE 3.68Å; D60-R88 PolarHBondContact OD2-NE 2.75Å; D60-R88 IonicContact OD2-NH2 3.93Å; D60-R88 PolarHBondContact OD2-NH2 3.19Å; D60-L124 VanDerWaalsContact C-CD1 3.42Å; D60-L124 WeakPolarHBondContact O-CD1 3.4Å; D60-L124 VanDerWaalsContact OD1-CD1 3.31Å; D60-L124 WeakPolarHBondContact OD1-CD1 3.39Å
61	R	98.8	Very high	98.3	Very high	71 Å²	71	56.4 Å²	56.4	27%	0.268	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	162.9	-168.5	61.5	171.8	177.8	79.9	4.3	112.6	N58 V65 I87	N58-R61 WeakPolarHBondContact O-CD 3.11Å; N58-R61 PolarHBondContact O-NE 3.17Å; N58-R61 PolarHBondContact OD1-NE 2.8Å; N58-R61 VanDerWaalsContact OD1-NE 3.16Å; R61-V65 HydrophobicContact CB-CG2 3.78Å; R61-V65 VanDerWaalsContact CD-O 3.23Å; R61-V65 WeakPolarHBondContact CD-O 3.39Å; R61-V65 HydrophobicContact CG-CG2 4.4Å; R61-V65 VanDerWaalsContact CZ-O 3.25Å; R61-V65 PolarHBondContact NE-O 2.81Å; R61-V65 PolarHBondContact NH1-O 2.9Å; R61-I87 HydrophobicContact CB-CB 3.98Å; R61-I87 HydrophobicContact CB-CD1 3.72Å; R61-I87 HydrophobicContact CB-CG1 3.72Å
62	S	98.8	Very high	98.3	Very high	6 Å²	6	59 Å²	59	4%	0.042	30%	0.296	C	S	.	.			trans	-58.4	146.8	157.6	177.4	0	0	0	0	110.7	N64 V65 D85 A86 L124	S62-N64 PolarHBondContact O-N 2.89Å; S62-N64 PolarHBondContact OG-N 3.06Å; S62-N64 VanDerWaalsContact OG-N 3.17Å; S62-V65 WeakPolarHBondContact O-CG2 3.43Å; S62-V65 PolarHBondContact O-N 3.32Å; S62-D85 PolarHBondContact OG-OD1 3.35Å; S62-A86 PolarHBondContact N-O 3.01Å; S62-L124 WeakPolarHBondContact CB-O 3.05Å
63	L	98.4	Very high	98.3	Very high	150 Å²	150	56.3 Å²	56.3	79%	0.785	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-20.8	173	-64.3	178	0	0	0	112.8	V65	L63-V65 VanDerWaalsContact C-N 3.32Å; L63-V65 PolarHBondContact O-N 3.36Å
64	N	98.7	Very high	98.3	Very high	38 Å²	38	51 Å²	51	20%	0.203	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	2	-178.7	-58.2	-40.8	0	0	0	114	S62 H78 V80 S83 D85	S62-N64 PolarHBondContact O-N 2.89Å; S62-N64 PolarHBondContact OG-N 3.06Å; S62-N64 VanDerWaalsContact OG-N 3.17Å; N64-H78 WeakPolarHBondContact O-CB 3.36Å; N64-H78 PolarHBondContact O-CD2 3.4Å; N64-H78 PolarHBondContact O-N 3.47Å; N64-V80 HydrophobicContact CB-CG2 4.07Å; N64-S83 PolarHBondContact ND2-OG 3.23Å; N64-D85 HydrophobicContact CB-CB 4.46Å; N64-D85 WeakPolarHBondContact CB-OD1 3.47Å; N64-D85 PolarHBondContact ND2-OD1 3.16Å
65	V	98.8	Very high	98.3	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	155.7	173.7	-55.9	0	0	0	0	109.7	R61 S62 L63 F75 H76 R77 D85 I87	R61-V65 HydrophobicContact CB-CG2 3.78Å; R61-V65 VanDerWaalsContact CD-O 3.23Å; R61-V65 WeakPolarHBondContact CD-O 3.39Å; R61-V65 HydrophobicContact CG-CG2 4.4Å; R61-V65 VanDerWaalsContact CZ-O 3.25Å; R61-V65 PolarHBondContact NE-O 2.81Å; R61-V65 PolarHBondContact NH1-O 2.9Å; S62-V65 WeakPolarHBondContact O-CG2 3.43Å; S62-V65 PolarHBondContact O-N 3.32Å; L63-V65 VanDerWaalsContact C-N 3.32Å; L63-V65 PolarHBondContact O-N 3.36Å; V65-F75 HydrophobicContact CB-CD2 3.87Å; V65-F75 HydrophobicContact CB-CE2 4.24Å; V65-F75 HydrophobicContact CG1-CD2 4.08Å; V65-F75 HydrophobicContact CG1-CE2 3.95Å; V65-H76 CarbonylContact C-O 3.35Å; V65-H76 VanDerWaalsContact CA-O 3.23Å; V65-H76 WeakPolarHBondContact CA-O 3.48Å; V65-R77 HydrophobicContact CG1-CB 3.9Å; V65-R77 HydrophobicContact CG1-CG 3.91Å; V65-D85 HydrophobicContact CG1-CB 3.8Å; V65-I87 HydrophobicContact CG2-CB 4.13Å; V65-I87 HydrophobicContact CG2-CD1 4.32Å
66	F	98.8	Very high	98.4	Very high	71 Å²	71	50.8 Å²	50.8	31%	0.311	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	147.3	172.6	62.8	-88.4	0	0	0	110.5	K68 F75 H76 H78	F66-K68 HydrophobicContact CE2-CG 4.43Å; F66-F75 CarbonylContact O-C 3.55Å; F66-F75 WeakPolarHBondContact O-CA 3.24Å; F66-F75 WeakPolarHBondContact O-CB 3.41Å; F66-H76 HydrophobicContact CD1-CB 4.47Å; F66-H76 HydrophobicContact CE1-CB 3.93Å; F66-H76 AromaticContact CE1-CD2 3.48Å; F66-H76 VanDerWaalsContact CE1-CD2 3.48Å; F66-H76 WeakPolarHBondContact CE1-CD2 3.49Å; F66-H76 AromaticContact CE1-CG 3.98Å; F66-H76 HydrophobicContact CE2-CB 3.99Å; F66-H76 HydrophobicContact CZ-CB 3.66Å; F66-H76 AromaticContact CZ-CD2 3.69Å; F66-H76 AromaticContact CZ-CG 3.81Å; F66-H76 PolarHBondContact N-O 2.99Å; F66-H76 PolarHBondContact O-N 2.97Å; F66-H78 AromaticContact CD1-CE1 3.8Å; F66-H78 AromaticContact CD1-NE2 3.43Å; F66-H78 WeakPolarHBondContact CD1-NE2 3.47Å; F66-H78 AromaticContact CE1-CE1 3.47Å; F66-H78 VanDerWaalsContact CE1-CE1 3.47Å; F66-H78 WeakPolarHBondContact CE1-CE1 3.1Å; F66-H78 AromaticContact CE1-NE2 3.62Å
67	V	98.8	Very high	98.4	Very high	6 Å²	6	50.9 Å²	50.9	4%	0.036	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	130.8	172.2	-178.1	0	0	0	0	108.7	W56 N58 K72 F75 I87	W56-V67 HydrophobicContact CB-CG2 3.72Å; N58-V67 HydrophobicContact CB-CB 4.07Å; N58-V67 HydrophobicContact CB-CG2 3.81Å; N58-V67 PolarHBondContact OD1-N 3.1Å; V67-K72 HydrophobicContact CG1-CD 4.33Å; V67-F75 HydrophobicContact CG2-CB 4.42Å; V67-I87 HydrophobicContact CG2-CD1 3.89Å
68	K	98.4	Very high	98.4	Very high	40 Å²	40	53.3 Å²	53.3	17%	0.174	27%	0.267	C	S	.	.			trans	-67.5	147.6	-176.6	-61.4	180	60.9	166	0	111.7	F66 D70 N71 V74 H76 E221	F66-K68 HydrophobicContact CE2-CG 4.43Å; K68-D70 VanDerWaalsContact CB-OD1 3.25Å; K68-D70 WeakPolarHBondContact CB-OD1 3.38Å; K68-D70 VanDerWaalsContact CE-OD1 3.22Å; K68-D70 WeakPolarHBondContact CE-OD1 3.19Å; K68-N71 CarbonylContact O-C 3.56Å; K68-V74 HydrophobicContact CD-CB 4.08Å; K68-V74 HydrophobicContact CD-CG1 3.7Å; K68-V74 HydrophobicContact CG-CG1 4.37Å; K68-V74 PolarHBondContact N-O 3.08Å; K68-H76 HydrophobicContact CG-CB 4.28Å; K68-E221 IonicContact NZ-OE1 3.71Å; K68-E221 PolarHBondContact NZ-OE1 3.37Å; K68-E221 IonicContact NZ-OE2 3.01Å; K68-E221 PolarHBondContact NZ-OE2 3.42Å
69	D	96.3	Very high	98.4	Very high	137 Å²	137	54.5 Å²	54.5	73%	0.733	28%	0.278	S	S	*	.	S	Bend	trans	-77.7	-37.6	-178.7	-75.1	-39.3	0	0	0	113.9	N71 K72	D69-N71 VanDerWaalsContact C-N 3.29Å; D69-K72 WeakPolarHBondContact O-CE 3.39Å; D69-K72 IonicContact OD1-NZ 3.42Å; D69-K72 PolarHBondContact OD1-NZ 2.73Å
70	D	96.6	Very high	98.4	Very high	130 Å²	130	49.9 Å²	49.9	70%	0.695	26%	0.255	S	S	*	.	S	Bend	trans	-72.2	-22.3	175.5	64.5	-29.8	0	0	0	112.7	K68	K68-D70 VanDerWaalsContact CB-OD1 3.25Å; K68-D70 WeakPolarHBondContact CB-OD1 3.38Å; K68-D70 VanDerWaalsContact CE-OD1 3.22Å; K68-D70 WeakPolarHBondContact CE-OD1 3.19Å
71	N	97.6	Very high	98.3	Very high	36 Å²	36	51.7 Å²	51.7	19%	0.193	28%	0.275	C	S	.	.			trans	-149.2	99.2	179.7	-170.4	-14.9	0	0	0	113.2	K68 D69 L73 V74 R223	K68-N71 CarbonylContact O-C 3.56Å; D69-N71 VanDerWaalsContact C-N 3.29Å; N71-L73 PolarHBondContact O-N 3.19Å; N71-L73 VanDerWaalsContact OD1-CB 3.3Å; N71-L73 WeakPolarHBondContact OD1-CB 3.45Å; N71-L73 PolarHBondContact OD1-N 3.27Å; N71-L73 VanDerWaalsContact OD1-N 3.07Å; N71-V74 HydrophobicContact CB-CG2 4.29Å; N71-V74 WeakPolarHBondContact ND2-CG2 3.48Å; N71-V74 PolarHBondContact O-N 3.39Å; N71-R223 PolarHBondContact ND2-NH1 3.49Å; N71-R223 VanDerWaalsContact ND2-NH1 3.14Å; N71-R223 PolarHBondContact ND2-NH2 3.02Å
72	K	97.9	Very high	98.2	Very high	77 Å²	77	53.8 Å²	53.8	34%	0.335	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-4.9	-178.3	-56.6	-63.5	171.9	-175.8	0	114.8	I52 S55 V67 D69	I52-K72 HydrophobicContact CG2-CB 4.41Å; S55-K72 VanDerWaalsContact CB-O 3.3Å; S55-K72 WeakPolarHBondContact CB-O 3.24Å; S55-K72 PolarHBondContact OG-O 2.85Å; V67-K72 HydrophobicContact CG1-CD 4.33Å; D69-K72 WeakPolarHBondContact O-CE 3.39Å; D69-K72 IonicContact OD1-NZ 3.42Å; D69-K72 PolarHBondContact OD1-NZ 2.73Å
73	L	98.6	Very high	98.2	Very high	6 Å²	6	53.6 Å²	53.6	3%	0.031	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-11.1	173.6	-56.9	-173.6	0	0	0	112.8	L48 Q51 I52 W56 N71 R223 I224	L48-L73 HydrophobicContact CD1-CD1 4.35Å; Q51-L73 HydrophobicContact CB-CD2 4.15Å; Q51-L73 WeakPolarHBondContact O-CD2 3.04Å; I52-L73 HydrophobicContact CG1-CD2 4.09Å; W56-L73 PolarHBondContact NE1-O 3.31Å; N71-L73 PolarHBondContact O-N 3.19Å; N71-L73 VanDerWaalsContact OD1-CB 3.3Å; N71-L73 WeakPolarHBondContact OD1-CB 3.45Å; N71-L73 PolarHBondContact OD1-N 3.27Å; N71-L73 VanDerWaalsContact OD1-N 3.07Å; L73-R223 HydrophobicContact CB-CG 3.94Å; L73-R223 CarbonylContact O-C 3.54Å; L73-R223 VanDerWaalsContact O-CA 3.28Å; L73-R223 WeakPolarHBondContact O-CA 3.42Å; L73-I224 WeakPolarHBondContact CB-O 3.34Å; L73-I224 PolarHBondContact O-N 3.09Å
74	V	98.9	Very high	98.2	Very high	6 Å²	6	46.4 Å²	46.4	4%	0.036	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	132.2	-173.3	-177.1	0	0	0	0	109.6	K68 N71 E221 I222 R223	K68-V74 HydrophobicContact CD-CB 4.08Å; K68-V74 HydrophobicContact CD-CG1 3.7Å; K68-V74 HydrophobicContact CG-CG1 4.37Å; K68-V74 PolarHBondContact N-O 3.08Å; N71-V74 HydrophobicContact CB-CG2 4.29Å; N71-V74 WeakPolarHBondContact ND2-CG2 3.48Å; N71-V74 PolarHBondContact O-N 3.39Å; V74-E221 HydrophobicContact CG1-CB 3.82Å; V74-E221 HydrophobicContact CG1-CG 4.27Å; V74-I222 WeakPolarHBondContact CA-O 3.26Å; V74-R223 HydrophobicContact CG2-CB 3.84Å; V74-R223 HydrophobicContact CG2-CG 3.83Å
75	F	98.8	Very high	98.3	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	153.6	161.8	81.1	-97.4	0	0	0	110.9	W56 V65 F66 V67 I87 V213 E221 I222	W56-F75 AromaticContact CD1-CD1 3.65Å; W56-F75 AromaticContact CD2-CD1 3.98Å; W56-F75 HydrophobicContact CD2-CD1 3.98Å; W56-F75 HydrophobicContact CD2-CE1 4.4Å; W56-F75 AromaticContact CE2-CD1 3.66Å; W56-F75 AromaticContact CE2-CE1 3.9Å; W56-F75 AromaticContact CG-CD1 3.97Å; W56-F75 HydrophobicContact CG-CD1 3.97Å; W56-F75 HydrophobicContact CZ2-CD1 4.28Å; W56-F75 HydrophobicContact CZ2-CE1 4.05Å; W56-F75 AromaticContact NE1-CD1 3.43Å; V65-F75 HydrophobicContact CB-CD2 3.87Å; V65-F75 HydrophobicContact CB-CE2 4.24Å; V65-F75 HydrophobicContact CG1-CD2 4.08Å; V65-F75 HydrophobicContact CG1-CE2 3.95Å; F66-F75 CarbonylContact O-C 3.55Å; F66-F75 WeakPolarHBondContact O-CA 3.24Å; F66-F75 WeakPolarHBondContact O-CB 3.41Å; V67-F75 HydrophobicContact CG2-CB 4.42Å; F75-I87 HydrophobicContact CB-CD1 4.22Å; F75-I87 HydrophobicContact CD1-CG2 3.43Å; F75-I87 VanDerWaalsContact CD1-CG2 3.43Å; F75-I87 HydrophobicContact CD2-CG2 4.3Å; F75-I87 HydrophobicContact CE1-CG2 3.26Å; F75-I87 HydrophobicContact CE2-CG2 4.18Å; F75-I87 HydrophobicContact CG-CD1 4.48Å; F75-I87 HydrophobicContact CG-CG2 3.93Å; F75-I87 HydrophobicContact CZ-CG2 3.65Å; F75-V213 HydrophobicContact CE1-CG2 3.46Å; F75-V213 VanDerWaalsContact CE1-CG2 3.46Å; F75-V213 HydrophobicContact CZ-CG2 3.57Å; F75-E221 VanDerWaalsContact O-CA 3.31Å; F75-E221 WeakPolarHBondContact O-CA 3.43Å; F75-I222 HydrophobicContact CD1-CB 4.11Å; F75-I222 HydrophobicContact CE1-CB 3.57Å; F75-I222 HydrophobicContact CE1-CD1 3.86Å; F75-I222 HydrophobicContact CE1-CG1 4.32Å; F75-I222 HydrophobicContact CE1-CG2 3.93Å; F75-I222 HydrophobicContact CE2-CD1 3.76Å; F75-I222 HydrophobicContact CZ-CB 3.85Å; F75-I222 HydrophobicContact CZ-CD1 3.2Å; F75-I222 HydrophobicContact CZ-CG1 4.1Å; F75-I222 HydrophobicContact CZ-CG2 4.47Å; F75-I222 PolarHBondContact N-O 3.17Å; F75-I222 VanDerWaalsContact N-O 3.14Å; F75-I222 PolarHBondContact O-N 2.67Å
76	H	98.9	Very high	98.3	Very high	26 Å²	26	44.6 Å²	44.6	12%	0.12	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	140.3	175.3	-178.7	93.4	0	0	0	109.8	V65 F66 K68 H219 C220 E221	V65-H76 CarbonylContact C-O 3.35Å; V65-H76 VanDerWaalsContact CA-O 3.23Å; V65-H76 WeakPolarHBondContact CA-O 3.48Å; F66-H76 HydrophobicContact CD1-CB 4.47Å; F66-H76 HydrophobicContact CE1-CB 3.93Å; F66-H76 AromaticContact CE1-CD2 3.48Å; F66-H76 VanDerWaalsContact CE1-CD2 3.48Å; F66-H76 WeakPolarHBondContact CE1-CD2 3.49Å; F66-H76 AromaticContact CE1-CG 3.98Å; F66-H76 HydrophobicContact CE2-CB 3.99Å; F66-H76 HydrophobicContact CZ-CB 3.66Å; F66-H76 AromaticContact CZ-CD2 3.69Å; F66-H76 AromaticContact CZ-CG 3.81Å; F66-H76 PolarHBondContact N-O 2.99Å; F66-H76 PolarHBondContact O-N 2.97Å; K68-H76 HydrophobicContact CG-CB 4.28Å; H76-H219 VanDerWaalsContact CE1-CA 3.47Å; H76-H219 WeakPolarHBondContact CE1-CA 3.48Å; H76-H219 AromaticContact CE1-ND1 3.75Å; H76-H219 AromaticContact NE2-ND1 3.58Å; H76-C220 WeakPolarHBondContact CA-O 2.99Å; H76-E221 HydrophobicContact CB-CG 4.36Å; H76-E221 IonicContact ND1-OE1 3.04Å
77	R	98.8	Very high	98.3	Very high	1 Å²	1	41.2 Å²	41.2	0%	0.004	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	128.1	174.4	-178.1	173.4	174.9	-74.3	-8.4	112	V65 V80 S83 D85 A215 V216 W217 H219 C220	V65-R77 HydrophobicContact CG1-CB 3.9Å; V65-R77 HydrophobicContact CG1-CG 3.91Å; R77-V80 PolarHBondContact NH2-O 3.45Å; R77-S83 PolarHBondContact NH2-O 3.34Å; R77-D85 IonicContact CZ-OD2 2.74Å; R77-D85 VanDerWaalsContact CZ-OD2 3.26Å; R77-D85 IonicContact NE-OD2 3.26Å; R77-D85 PolarHBondContact NE-OD2 3.36Å; R77-D85 IonicContact NH2-OD2 2.84Å; R77-D85 PolarHBondContact NH2-OD2 3.24Å; R77-A215 PolarHBondContact NE-O 3.23Å; R77-V216 VanDerWaalsContact NH1-C 3.33Å; R77-V216 PolarHBondContact NH1-O 2.94Å; R77-W217 WeakPolarHBondContact CD-O 3.48Å; R77-W217 PolarHBondContact NH1-O 2.92Å; R77-H219 VanDerWaalsContact O-CA 3.28Å; R77-H219 WeakPolarHBondContact O-CA 3.24Å; R77-H219 PolarHBondContact O-N 3.28Å; R77-C220 VanDerWaalsContact CB-SG 3.56Å; R77-C220 PolarHBondContact N-O 2.65Å
78	H	98.6	Very high	98.3	Very high	82 Å²	82	41.6 Å²	41.6	38%	0.38	23%	0.225	S	C	.	.			trans	-63.1	147.8	171.1	-70.3	-64.2	0	0	0	111.5	N64 F66 V80	N64-H78 WeakPolarHBondContact O-CB 3.36Å; N64-H78 PolarHBondContact O-CD2 3.4Å; N64-H78 PolarHBondContact O-N 3.47Å; F66-H78 AromaticContact CD1-CE1 3.8Å; F66-H78 AromaticContact CD1-NE2 3.43Å; F66-H78 WeakPolarHBondContact CD1-NE2 3.47Å; F66-H78 AromaticContact CE1-CE1 3.47Å; F66-H78 VanDerWaalsContact CE1-CE1 3.47Å; F66-H78 WeakPolarHBondContact CE1-CE1 3.1Å; F66-H78 AromaticContact CE1-NE2 3.62Å; H78-V80 HydrophobicContact CB-CG2 3.97Å; H78-V80 PolarHBondContact O-N 3.32Å
79	P	98.2	Very high	98.3	Very high	77 Å²	77	39.7 Å²	39.7	50%	0.5	22%	0.217	S	C	.	.			trans	-76.4	63.4	-178.9	35.4	-39.5	0	0	0	112.3	H219	P79-H219 WeakPolarHBondContact CG-NE2 3.18Å
80	V	98.3	Very high	98.4	Very high	51 Å²	51	38.3 Å²	38.3	31%	0.309	20%	0.201	S	C	.	.			trans	-90	121.4	179.4	-173.2	0	0	0	0	109.4	N64 R77 H78	N64-V80 HydrophobicContact CB-CG2 4.07Å; R77-V80 PolarHBondContact NH2-O 3.45Å; H78-V80 HydrophobicContact CB-CG2 3.97Å; H78-V80 PolarHBondContact O-N 3.32Å
81	A	97.3	Very high	98.5	Very high	74 Å²	74	34.2 Å²	34.2	61%	0.612	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.3	150.9	178.1	0	0	0	0	0	111.5	S83	A81-S83 PolarHBondContact O-N 2.82Å
82	Q	97.8	Very high	98.6	Very high	115 Å²	115	33.1 Å²	33.1	54%	0.537	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.5	42.6	178.3	-61.9	-62.1	-34.6	0	0	112.6	G128 Y129	Q82-G128 PolarHBondContact O-N 2.97Å; Q82-Y129 VanDerWaalsContact N-CZ 3.32Å; Q82-Y129 PolarHBondContact N-OH 3.28Å
83	S	98.6	Very high	98.6	Very high	2 Å²	2	29.9 Å²	29.9	1%	0.014	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	136.1	-179.5	-178.4	0	0	0	0	109.9	N64 R77 A81 D85 H125 G128	N64-S83 PolarHBondContact ND2-OG 3.23Å; R77-S83 PolarHBondContact NH2-O 3.34Å; A81-S83 PolarHBondContact O-N 2.82Å; S83-D85 PolarHBondContact OG-OD1 3.44Å; S83-D85 PolarHBondContact OG-OD2 2.87Å; S83-H125 PolarHBondContact OG-CE1 2.94Å; S83-H125 PolarHBondContact OG-ND1 2.77Å; S83-G128 CarbonylContact C-O 3.53Å
84	T	98.8	Very high	98.5	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	128.6	165.9	-54.6	0	0	0	0	108	H125 S126 G128 T130 L132 V216	T84-H125 WeakPolarHBondContact O-CA 3.45Å; T84-H125 PolarHBondContact O-ND1 3.15Å; T84-S126 PolarHBondContact N-O 3.44Å; T84-S126 PolarHBondContact O-N 3.42Å; T84-G128 PolarHBondContact N-O 3.03Å; T84-G128 PolarHBondContact OG1-O 3.33Å; T84-T130 WeakPolarHBondContact CG2-O 3.27Å; T84-T130 PolarHBondContact OG1-N 3.17Å; T84-T130 PolarHBondContact OG1-OG1 3.25Å; T84-L132 HydrophobicContact CG2-CB 3.53Å; T84-L132 HydrophobicContact CG2-CD2 4.16Å; T84-V216 HydrophobicContact CG2-CG1 4Å
85	D	98.9	Very high	98.4	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	135.1	-169.8	-58.6	-75.2	0	0	0	110.6	S62 N64 V65 R77 S83 H125 S214 A215	S62-D85 PolarHBondContact OG-OD1 3.35Å; N64-D85 HydrophobicContact CB-CB 4.46Å; N64-D85 WeakPolarHBondContact CB-OD1 3.47Å; N64-D85 PolarHBondContact ND2-OD1 3.16Å; V65-D85 HydrophobicContact CG1-CB 3.8Å; R77-D85 IonicContact CZ-OD2 2.74Å; R77-D85 VanDerWaalsContact CZ-OD2 3.26Å; R77-D85 IonicContact NE-OD2 3.26Å; R77-D85 PolarHBondContact NE-OD2 3.36Å; R77-D85 IonicContact NH2-OD2 2.84Å; R77-D85 PolarHBondContact NH2-OD2 3.24Å; S83-D85 PolarHBondContact OG-OD1 3.44Å; S83-D85 PolarHBondContact OG-OD2 2.87Å; D85-H125 IonicContact OD1-CE1 2.91Å; D85-H125 IonicContact OD1-ND1 3.51Å; D85-H125 PolarHBondContact OD1-ND1 3.33Å; D85-S214 CarbonylContact O-C 3.53Å; D85-S214 WeakPolarHBondContact O-CA 3.47Å; D85-A215 PolarHBondContact N-O 3.42Å; D85-A215 PolarHBondContact O-N 2.89Å
86	A	98.9	Very high	98.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	163.8	-177.8	0	0	0	0	0	112.1	S62 L124 L132 I212 V213	S62-A86 PolarHBondContact N-O 3.01Å; A86-L124 HydrophobicContact CB-CB 4.38Å; A86-L124 HydrophobicContact CB-CD2 3.98Å; A86-L124 PolarHBondContact N-O 3.49Å; A86-L132 HydrophobicContact CB-CD2 4.14Å; A86-I212 HydrophobicContact CB-CD1 4.41Å; A86-I212 HydrophobicContact CB-CG1 4.35Å; A86-V213 WeakPolarHBondContact CA-O 3.34Å; A86-V213 WeakPolarHBondContact CB-O 3.21Å
87	I	98.9	Very high	98.2	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	141	178.7	179.3	161.6	0	0	0	109	W56 R61 V65 V67 F75 I212 V213	W56-I87 HydrophobicContact CB-CD1 3.82Å; W56-I87 HydrophobicContact CB-CG1 4.28Å; W56-I87 HydrophobicContact CD2-CG2 4.27Å; W56-I87 HydrophobicContact CE3-CG1 4.34Å; W56-I87 HydrophobicContact CE3-CG2 4.06Å; W56-I87 HydrophobicContact CG-CD1 4.41Å; W56-I87 HydrophobicContact CZ3-CG2 4.44Å; R61-I87 HydrophobicContact CB-CB 3.98Å; R61-I87 HydrophobicContact CB-CD1 3.72Å; R61-I87 HydrophobicContact CB-CG1 3.72Å; V65-I87 HydrophobicContact CG2-CB 4.13Å; V65-I87 HydrophobicContact CG2-CD1 4.32Å; V67-I87 HydrophobicContact CG2-CD1 3.89Å; F75-I87 HydrophobicContact CB-CD1 4.22Å; F75-I87 HydrophobicContact CD1-CG2 3.43Å; F75-I87 VanDerWaalsContact CD1-CG2 3.43Å; F75-I87 HydrophobicContact CD2-CG2 4.3Å; F75-I87 HydrophobicContact CE1-CG2 3.26Å; F75-I87 HydrophobicContact CE2-CG2 4.18Å; F75-I87 HydrophobicContact CG-CD1 4.48Å; F75-I87 HydrophobicContact CG-CG2 3.93Å; F75-I87 HydrophobicContact CZ-CG2 3.65Å; I87-I212 WeakPolarHBondContact O-CA 3.42Å; I87-I212 WeakPolarHBondContact O-CG1 3.28Å; I87-V213 HydrophobicContact CG2-CG2 4.21Å; I87-V213 PolarHBondContact N-O 3.12Å; I87-V213 PolarHBondContact O-N 2.61Å
88	R	98.9	Very high	98.2	Very high	14 Å²	14	40.1 Å²	40.1	5%	0.053	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	154.3	175.4	-83.2	-177.9	-70.4	-109.1	-3.1	111.9	N57 D60 T119 S120 A122 L124 P211 I212	N57-R88 WeakPolarHBondContact CB-O 3.37Å; N57-R88 PolarHBondContact N-O 3.04Å; D60-R88 PolarHBondContact O-N 3.36Å; D60-R88 VanDerWaalsContact O-N 3.16Å; D60-R88 IonicContact OD1-CZ 3.87Å; D60-R88 IonicContact OD1-NE 3.8Å; D60-R88 PolarHBondContact OD1-NE 2.81Å; D60-R88 IonicContact OD1-NH2 3.47Å; D60-R88 PolarHBondContact OD1-NH2 3.26Å; D60-R88 IonicContact OD2-CZ 2.69Å; D60-R88 IonicContact OD2-NE 3.68Å; D60-R88 PolarHBondContact OD2-NE 2.75Å; D60-R88 IonicContact OD2-NH2 3.93Å; D60-R88 PolarHBondContact OD2-NH2 3.19Å; R88-T119 PolarHBondContact NH1-O 2.84Å; R88-S120 VanDerWaalsContact CZ-O 3.29Å; R88-S120 PolarHBondContact NH1-O 2.82Å; R88-S120 VanDerWaalsContact NH1-O 3.12Å; R88-S120 PolarHBondContact NH2-O 3.36Å; R88-S120 VanDerWaalsContact NH2-O 3.08Å; R88-A122 PolarHBondContact NH1-O 2.85Å; R88-L124 HydrophobicContact CG-CD2 4.17Å; R88-P211 CarbonylContact C-O 3.4Å; R88-P211 VanDerWaalsContact CA-O 3.26Å; R88-P211 WeakPolarHBondContact CA-O 3.01Å; R88-I212 HydrophobicContact CG-CB 4.1Å; R88-I212 HydrophobicContact CG-CD1 3.96Å; R88-I212 HydrophobicContact CG-CG1 4Å
89	G	98.8	Very high	98.2	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	159.7	164.4	0	0	0	0	0	111.5	S55 Y210 P211	S55-G89 CarbonylContact O-C 3.55Å; S55-G89 WeakPolarHBondContact O-CA 3.44Å; G89-Y210 WeakPolarHBondContact O-CD1 3.49Å; G89-P211 PolarHBondContact N-O 3.43Å
90	R	98.7	Very high	98.2	Very high	108 Å²	108	32.7 Å²	32.7	41%	0.408	17%	0.169	S	C	.	.	S	Bend	trans	-66.9	-37	179.5	-72.2	168.7	177.8	-104.2	-3.2	113.2	Q53 S55 W56 N57	Q53-R90 WeakPolarHBondContact O-CB 3.3Å; S55-R90 WeakPolarHBondContact O-CG 3.4Å; S55-R90 PolarHBondContact O-N 3.19Å; W56-R90 PolarHBondContact O-NE 3.44Å; N57-R90 HydrophobicContact CB-CG 3.8Å
91	V	98.6	Very high	98.3	Very high	43 Å²	43	31.9 Å²	31.9	26%	0.261	16%	0.162	S	C	.	.	P	Polyproline II helix	trans	-99.2	126.2	-174	-178.2	0	0	0	0	110.1	Y93 P211	V91-Y93 HydrophobicContact CB-CE1 4.15Å; V91-Y93 HydrophobicContact CG1-CD1 3.86Å; V91-Y93 HydrophobicContact CG1-CE1 3.56Å; V91-P211 WeakPolarHBondContact O-CD 3.07Å
92	G	98.6	Very high	98.3	Very high	14 Å²	14	28.4 Å²	28.4	14%	0.144	13%	0.133	C	C	.	.	P	Polyproline II helix	trans	-99.5	119.2	169.1	0	0	0	0	0	110	L209 Y210	G92-L209 CarbonylContact C-O 3.59Å; G92-L209 WeakPolarHBondContact CA-O 3.19Å; G92-Y210 VanDerWaalsContact CA-CD1 3.42Å; G92-Y210 VanDerWaalsContact CA-CE1 3.4Å; G92-Y210 VanDerWaalsContact N-CE1 3.26Å
93	Y	98.5	Very high	98.4	Very high	8 Å²	8	25.5 Å²	25.5	3%	0.031	12%	0.121	C	C	.	.	B	Isolated β-bridge	trans	-86.2	141.4	-176.2	-51.3	-70	0	0	0	111.2	H54 V91 H98 W100 L181 K208 L209 P211 Y226	H54-Y93 AromaticContact CE1-CE1 3.74Å; H54-Y93 AromaticContact ND1-CE1 3.58Å; H54-Y93 AromaticContact ND1-CZ 3.63Å; H54-Y93 PolarHBondContact ND1-OH 3.1Å; V91-Y93 HydrophobicContact CB-CE1 4.15Å; V91-Y93 HydrophobicContact CG1-CD1 3.86Å; V91-Y93 HydrophobicContact CG1-CE1 3.56Å; Y93-H98 HydrophobicContact CD1-CB 4.43Å; Y93-H98 AromaticContact CD1-CD2 3.48Å; Y93-H98 VanDerWaalsContact CD1-CD2 3.48Å; Y93-H98 WeakPolarHBondContact CD1-CD2 3.16Å; Y93-H98 AromaticContact CD1-CE1 3.43Å; Y93-H98 VanDerWaalsContact CD1-CE1 3.43Å; Y93-H98 WeakPolarHBondContact CD1-CE1 3.38Å; Y93-H98 AromaticContact CD1-CG 3.56Å; Y93-H98 AromaticContact CD1-ND1 3.53Å; Y93-H98 AromaticContact CD1-NE2 3.36Å; Y93-H98 WeakPolarHBondContact CD1-NE2 3.5Å; Y93-H98 HydrophobicContact CD2-CB 4.49Å; Y93-H98 HydrophobicContact CE1-CB 4.38Å; Y93-H98 AromaticContact CE1-CE1 3.78Å; Y93-H98 AromaticContact CE1-CG 3.77Å; Y93-H98 AromaticContact CE1-ND1 3.52Å; Y93-H98 HydrophobicContact CE2-CB 4.42Å; Y93-H98 HydrophobicContact CG-CB 4.47Å; Y93-H98 AromaticContact CG-CD2 3.58Å; Y93-H98 AromaticContact CG-CG 3.87Å; Y93-H98 AromaticContact CG-NE2 3.84Å; Y93-W100 HydrophobicContact CD2-CZ3 4.21Å; Y93-W100 HydrophobicContact CE2-CE3 4.2Å; Y93-W100 HydrophobicContact CE2-CH2 4.38Å; Y93-W100 AromaticContact CE2-CZ3 3.76Å; Y93-W100 HydrophobicContact CE2-CZ3 3.76Å; Y93-L181 HydrophobicContact CD2-CD2 3.77Å; Y93-L181 HydrophobicContact CG-CD2 4.3Å; Y93-K208 WeakPolarHBondContact O-CA 3.38Å; Y93-L209 PolarHBondContact N-O 2.7Å; Y93-L209 PolarHBondContact O-N 2.89Å; Y93-P211 HydrophobicContact CE2-CG 3.78Å; Y93-Y226 HydrophobicContact CE1-CE2 4.23Å; Y93-Y226 AromaticContact CZ-CE2 4Å; Y93-Y226 WeakPolarHBondContact OH-CD2 3.37Å; Y93-Y226 WeakPolarHBondContact OH-CE2 3.33Å
94	T	97.8	Very high	98.4	Very high	81 Å²	81	25.4 Å²	25.4	50%	0.497	12%	0.121	S	C	.	.			trans	-127.4	-14.5	-178.5	51.9	0	0	0	0	113.5	K208	T94-K208 HydrophobicContact CG2-CB 3.74Å; T94-K208 HydrophobicContact CG2-CD 4.3Å; T94-K208 HydrophobicContact CG2-CG 3.74Å
95	R	96.4	Very high	98.3	Very high	150 Å²	150	26 Å²	26	57%	0.566	13%	0.126	S	C	*	.	S	Bend	trans	-157.6	164.9	-177.2	70.1	-177.3	-168.4	-165.3	2.5	108.9	H98 M183 D231 P232	R95-H98 PolarHBondContact O-NE2 3.28Å; R95-M183 VanDerWaalsContact CA-CB 3.49Å; R95-D231 IonicContact NE-OD1 2.81Å; R95-D231 IonicContact NH2-OD1 3.92Å; R95-P232 HydrophobicContact CB-CG 3.92Å; R95-P232 HydrophobicContact CG-CG 4.14Å
96	G	95.9	Very high	98.2	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.147	C	C	.	.	S	Bend	trans	82	172.5	176.3	0	0	0	0	0	114	M183 D184 L230	G96-M183 WeakPolarHBondContact O-CB 3.48Å; G96-M183 PolarHBondContact O-N 3.19Å; G96-D184 VanDerWaalsContact CA-OD2 3.24Å; G96-D184 WeakPolarHBondContact CA-OD2 3.49Å; G96-D184 VanDerWaalsContact N-CG 3.34Å; G96-D184 PolarHBondContact N-OD1 3.09Å; G96-D184 PolarHBondContact N-OD2 3.26Å; G96-L230 CarbonylContact C-O 3.56Å; G96-L230 WeakPolarHBondContact CA-O 3.32Å
97	L	97.4	Very high	98.1	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.01	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	128.8	173.2	176.2	67.9	0	0	0	109	R36 L37 L40 V180 L181 D182 G229 L230	R36-L97 HydrophobicContact CB-CD2 4.02Å; L37-L97 HydrophobicContact CB-CD2 4.18Å; L37-L97 HydrophobicContact CD1-CD2 4.48Å; L40-L97 HydrophobicContact CB-CD2 4.42Å; L40-L97 HydrophobicContact CD1-CB 4.33Å; L40-L97 HydrophobicContact CD1-CD2 3.79Å; L40-L97 HydrophobicContact CD1-CG 3.75Å; L97-V180 HydrophobicContact CD1-CG1 3.72Å; L97-L181 CarbonylContact C-O 3.39Å; L97-L181 WeakPolarHBondContact CA-O 3.26Å; L97-D182 HydrophobicContact CD1-CB 3.75Å; L97-G229 CarbonylContact O-C 3.53Å; L97-G229 WeakPolarHBondContact O-CA 3.45Å; L97-L230 HydrophobicContact CB-CB 4.4Å; L97-L230 PolarHBondContact N-O 2.97Å; L97-L230 PolarHBondContact O-N 3.16Å
98	H	98.4	Very high	98	Very high	22 Å²	22	42.4 Å²	42.4	10%	0.102	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	137	-178.4	-62.5	-76.6	0	0	0	110.7	Y93 R95 W100 L181 Y226	Y93-H98 HydrophobicContact CD1-CB 4.43Å; Y93-H98 AromaticContact CD1-CD2 3.48Å; Y93-H98 VanDerWaalsContact CD1-CD2 3.48Å; Y93-H98 WeakPolarHBondContact CD1-CD2 3.16Å; Y93-H98 AromaticContact CD1-CE1 3.43Å; Y93-H98 VanDerWaalsContact CD1-CE1 3.43Å; Y93-H98 WeakPolarHBondContact CD1-CE1 3.38Å; Y93-H98 AromaticContact CD1-CG 3.56Å; Y93-H98 AromaticContact CD1-ND1 3.53Å; Y93-H98 AromaticContact CD1-NE2 3.36Å; Y93-H98 WeakPolarHBondContact CD1-NE2 3.5Å; Y93-H98 HydrophobicContact CD2-CB 4.49Å; Y93-H98 HydrophobicContact CE1-CB 4.38Å; Y93-H98 AromaticContact CE1-CE1 3.78Å; Y93-H98 AromaticContact CE1-CG 3.77Å; Y93-H98 AromaticContact CE1-ND1 3.52Å; Y93-H98 HydrophobicContact CE2-CB 4.42Å; Y93-H98 HydrophobicContact CG-CB 4.47Å; Y93-H98 AromaticContact CG-CD2 3.58Å; Y93-H98 AromaticContact CG-CG 3.87Å; Y93-H98 AromaticContact CG-NE2 3.84Å; R95-H98 PolarHBondContact O-NE2 3.28Å; H98-W100 HydrophobicContact CB-CE3 4.4Å; H98-W100 HydrophobicContact CB-CZ3 4.1Å; H98-L181 PolarHBondContact N-O 2.83Å; H98-L181 PolarHBondContact O-N 3.45Å; H98-Y226 HydrophobicContact CB-CE2 4.26Å; H98-Y226 AromaticContact ND1-CZ 3.9Å; H98-Y226 PolarHBondContact ND1-OH 3.26Å
99	V	98.7	Very high	97.9	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	132.8	175.5	-177.3	0	0	0	0	110.1	L37 L40 L41 L178 V179 V180 I227 N228	L37-V99 HydrophobicContact CD1-CG2 3.62Å; L40-V99 HydrophobicContact CD1-CG2 4.03Å; L40-V99 HydrophobicContact CD2-CB 3.79Å; L40-V99 HydrophobicContact CD2-CG2 3.6Å; L40-V99 HydrophobicContact CG-CG2 4.47Å; L41-V99 HydrophobicContact CD2-CG1 4.13Å; V99-L178 HydrophobicContact CG1-CB 4.07Å; V99-L178 HydrophobicContact CG1-CD1 4.32Å; V99-V179 WeakPolarHBondContact CA-O 3.29Å; V99-V180 HydrophobicContact CG2-CG1 4.24Å; V99-V180 HydrophobicContact CG2-CG2 4.19Å; V99-I227 HydrophobicContact CB-CB 4.23Å; V99-I227 HydrophobicContact CG1-CB 4.1Å; V99-I227 HydrophobicContact CG1-CG1 4.06Å; V99-I227 WeakPolarHBondContact O-CA 3.47Å; V99-I227 WeakPolarHBondContact O-CB 3.35Å; V99-I227 PolarHBondContact O-N 2.85Å; V99-N228 PolarHBondContact N-O 2.67Å; V99-N228 PolarHBondContact O-N 2.85Å
100	W	98.9	Very high	97.8	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.008	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	150.2	169.9	61	91.4	0	0	0	110.7	Y93 H98 V117 L178 V179 L181 P211 I224 R225 Y226	Y93-W100 HydrophobicContact CD2-CZ3 4.21Å; Y93-W100 HydrophobicContact CE2-CE3 4.2Å; Y93-W100 HydrophobicContact CE2-CH2 4.38Å; Y93-W100 AromaticContact CE2-CZ3 3.76Å; Y93-W100 HydrophobicContact CE2-CZ3 3.76Å; H98-W100 HydrophobicContact CB-CE3 4.4Å; H98-W100 HydrophobicContact CB-CZ3 4.1Å; W100-V117 HydrophobicContact CH2-CG1 3.74Å; W100-V117 HydrophobicContact CZ2-CG1 3.85Å; W100-L178 WeakPolarHBondContact O-CA 3.42Å; W100-V179 HydrophobicContact CD2-CB 4.11Å; W100-V179 HydrophobicContact CG-CB 4.4Å; W100-V179 HydrophobicContact CH2-CG1 4.06Å; W100-V179 HydrophobicContact CZ2-CB 3.85Å; W100-V179 HydrophobicContact CZ2-CG1 3.42Å; W100-V179 VanDerWaalsContact CZ2-CG1 3.42Å; W100-V179 PolarHBondContact N-O 2.97Å; W100-V179 PolarHBondContact O-N 3.29Å; W100-L181 HydrophobicContact CH2-CB 3.67Å; W100-L181 HydrophobicContact CH2-CD2 3.99Å; W100-L181 HydrophobicContact CH2-CG 4.45Å; W100-L181 HydrophobicContact CZ3-CB 3.71Å; W100-L181 HydrophobicContact CZ3-CD2 4.2Å; W100-P211 HydrophobicContact CD2-CB 4.42Å; W100-P211 HydrophobicContact CD2-CG 4.11Å; W100-P211 HydrophobicContact CE3-CG 4.3Å; W100-P211 HydrophobicContact CH2-CB 4.48Å; W100-P211 HydrophobicContact CH2-CG 4.04Å; W100-P211 HydrophobicContact CZ2-CB 3.8Å; W100-P211 HydrophobicContact CZ2-CG 3.82Å; W100-P211 HydrophobicContact CZ3-CG 4.27Å; W100-I224 HydrophobicContact CB-CG1 4.29Å; W100-I224 HydrophobicContact CG-CD1 4.19Å; W100-I224 HydrophobicContact CG-CG1 4.32Å; W100-R225 CarbonylContact C-O 3.35Å; W100-R225 WeakPolarHBondContact CA-O 3.4Å; W100-Y226 HydrophobicContact CB-CD2 4.39Å
101	E	98.8	Very high	97.6	Very high	35 Å²	35	42.3 Å²	42.3	16%	0.164	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	139	171.7	180	-178.7	-104.5	0	0	110	L177 L178 I224 R225 I227	E101-L177 WeakPolarHBondContact CA-O 3.36Å; E101-L178 HydrophobicContact CB-CD2 3.56Å; E101-L178 HydrophobicContact CG-CD2 4.01Å; E101-I224 WeakPolarHBondContact O-CA 3.48Å; E101-R225 HydrophobicContact CB-CB 4.3Å; E101-R225 PolarHBondContact N-O 2.97Å; E101-R225 PolarHBondContact O-N 3.13Å; E101-R225 IonicContact OE1-NH2 2.65Å; E101-R225 PolarHBondContact OE1-NH2 3.12Å; E101-R225 IonicContact OE2-CZ 2.85Å; E101-R225 VanDerWaalsContact OE2-CZ 3.28Å; E101-R225 IonicContact OE2-NE 3.58Å; E101-R225 PolarHBondContact OE2-NE 3.1Å; E101-R225 IonicContact OE2-NH2 3.66Å; E101-R225 PolarHBondContact OE2-NH2 3.45Å; E101-I227 HydrophobicContact CB-CD1 4.05Å; E101-I227 HydrophobicContact CB-CG1 4.46Å
102	I	98.9	Very high	97.6	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	120.3	164	-62.9	-63.4	0	0	0	107.3	W56 W104 V115 S176 L177 V179 V213 I222 R223 I224	W56-I102 HydrophobicContact CH2-CD1 3.83Å; W56-I102 HydrophobicContact CZ2-CD1 3.76Å; I102-W104 HydrophobicContact CG2-CB 4.21Å; I102-V115 HydrophobicContact CB-CG1 4.48Å; I102-V115 HydrophobicContact CG1-CG1 3.85Å; I102-V115 HydrophobicContact CG2-CG2 4.23Å; I102-S176 WeakPolarHBondContact O-CA 3.47Å; I102-L177 HydrophobicContact CB-CD2 4.41Å; I102-L177 HydrophobicContact CB-CG 4.44Å; I102-L177 PolarHBondContact N-O 2.83Å; I102-L177 PolarHBondContact O-N 2.85Å; I102-V179 HydrophobicContact CG1-CG2 4.06Å; I102-V213 HydrophobicContact CD1-CG1 4.42Å; I102-I222 HydrophobicContact CG2-CG2 4Å; I102-R223 WeakPolarHBondContact CA-O 3.44Å; I102-I224 HydrophobicContact CD1-CB 4.06Å; I102-I224 HydrophobicContact CD1-CD1 4.23Å; I102-I224 HydrophobicContact CD1-CG1 3.94Å
103	N	98.8	Very high	97.6	Very high	54 Å²	54	40.6 Å²	40.6	29%	0.289	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	113.8	168.3	179.6	-94.5	0	0	0	108.7	D175 S176 R223	N103-D175 CarbonylContact C-O 3.55Å; N103-D175 WeakPolarHBondContact CA-O 3.34Å; N103-S176 PolarHBondContact ND2-OG 3.49Å; N103-R223 HydrophobicContact CB-CB 4.17Å; N103-R223 PolarHBondContact N-O 2.97Å; N103-R223 PolarHBondContact O-N 2.81Å
104	W	98.4	Very high	97.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	104.9	-178.2	-172	-9.7	0	0	0	109	I102 M106 Q108 R109 A113 V115 L144 D175 V213 S214 A215 I222	I102-W104 HydrophobicContact CG2-CB 4.21Å; W104-M106 PolarHBondContact O-N 2.99Å; W104-Q108 PolarHBondContact NE1-O 3.17Å; W104-R109 HydrophobicContact CD2-CG 4.33Å; W104-R109 HydrophobicContact CG-CG 4.28Å; W104-R109 PolarHBondContact O-NE 2.87Å; W104-R109 PolarHBondContact O-NH2 3.45Å; W104-A113 HydrophobicContact CD2-CB 4.48Å; W104-A113 HydrophobicContact CE3-CB 4.36Å; W104-A113 HydrophobicContact CH2-CB 3.5Å; W104-A113 HydrophobicContact CZ2-CB 3.62Å; W104-A113 HydrophobicContact CZ3-CB 3.9Å; W104-V115 HydrophobicContact CE3-CG2 4.09Å; W104-V115 HydrophobicContact CZ3-CG2 4.19Å; W104-L144 HydrophobicContact CE3-CD1 4.42Å; W104-D175 CarbonylContact C-O 3.51Å; W104-D175 PolarHBondContact N-O 3.19Å; W104-V213 HydrophobicContact CZ3-CB 4.17Å; W104-S214 WeakPolarHBondContact CH2-O 3.48Å; W104-A215 HydrophobicContact CH2-CB 3.58Å; W104-A215 HydrophobicContact CZ2-CB 3.57Å; W104-I222 HydrophobicContact CB-CG1 4.19Å; W104-I222 HydrophobicContact CB-CG2 4.37Å; W104-I222 HydrophobicContact CD2-CD1 3.75Å; W104-I222 HydrophobicContact CD2-CG1 3.53Å; W104-I222 HydrophobicContact CE3-CD1 4.01Å; W104-I222 HydrophobicContact CE3-CG1 4.03Å; W104-I222 HydrophobicContact CE3-CG2 4.37Å; W104-I222 HydrophobicContact CG-CD1 4.33Å; W104-I222 HydrophobicContact CG-CG1 3.61Å; W104-I222 HydrophobicContact CH2-CD1 3.88Å; W104-I222 HydrophobicContact CZ2-CD1 3.62Å; W104-I222 HydrophobicContact CZ2-CG1 4.3Å; W104-I222 HydrophobicContact CZ3-CD1 4.07Å
105	A	97.8	Very high	97.7	Very high	13 Å²	13	36.4 Å²	36.4	11%	0.107	17%	0.173	C	C	.	.			trans	-50.9	127.1	-179.5	0	0	0	0	0	111.7	R107 Q108 D175	A105-R107 HydrophobicContact CB-CG 4.39Å; A105-R107 PolarHBondContact O-N 3.34Å; A105-R107 VanDerWaalsContact O-N 3.17Å; A105-Q108 HydrophobicContact CB-CB 4.34Å; A105-Q108 HydrophobicContact CB-CG 4.14Å; A105-Q108 WeakPolarHBondContact O-CA 3.21Å; A105-Q108 PolarHBondContact O-N 3.08Å; A105-D175 WeakPolarHBondContact CA-OD1 3.41Å
106	M	95.5	Very high	97.8	Very high	93 Å²	93	29.3 Å²	29.3	46%	0.458	15%	0.146	S	C	.	.	G	3₁₀ helix	trans	-53.9	-40.9	-176.2	-172.9	-175.9	-177.1	0	0	112.2	W104 Q108 R109 I172 D175	W104-M106 PolarHBondContact O-N 2.99Å; M106-Q108 PolarHBondContact O-N 2.96Å; M106-Q108 VanDerWaalsContact O-N 3.16Å; M106-R109 PolarHBondContact O-N 2.98Å; M106-I172 HydrophobicContact CE-CG1 4.36Å; M106-I172 HydrophobicContact CE-CG2 3.92Å; M106-I172 HydrophobicContact SD-CG2 4.24Å; M106-D175 PolarHBondContact N-OD1 2.88Å
107	R	96.4	Very high	97.9	Very high	207 Å²	207	29.3 Å²	29.3	78%	0.781	15%	0.146	S	C	*	.	G	3₁₀ helix	trans	-66.7	-10	177.5	68.7	-175.5	176.5	-138.2	-1.7	115	A105	A105-R107 HydrophobicContact CB-CG 4.39Å; A105-R107 PolarHBondContact O-N 3.34Å; A105-R107 VanDerWaalsContact O-N 3.17Å
108	Q	97.5	Very high	98	Very high	44 Å²	44	29.2 Å²	29.2	21%	0.206	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-111.3	17.7	-178.9	-63.1	-173.6	-15.2	0	0	112.8	W104 A105 M106 W217 C220	W104-Q108 PolarHBondContact NE1-O 3.17Å; A105-Q108 HydrophobicContact CB-CB 4.34Å; A105-Q108 HydrophobicContact CB-CG 4.14Å; A105-Q108 WeakPolarHBondContact O-CA 3.21Å; A105-Q108 PolarHBondContact O-N 3.08Å; M106-Q108 PolarHBondContact O-N 2.96Å; M106-Q108 VanDerWaalsContact O-N 3.16Å; Q108-W217 HydrophobicContact CB-CG 4.45Å; Q108-W217 WeakPolarHBondContact O-CB 3.43Å; Q108-C220 HydrophobicContact CB-CB 3.86Å; Q108-C220 WeakPolarHBondContact O-CB 3.4Å
109	R	97.6	Very high	98	Very high	11 Å²	11	28.8 Å²	28.8	4%	0.042	15%	0.145	C	C	.	.			trans	-88.1	-35.2	-177.9	-70.5	-178.2	-173.1	162.2	6.5	113.5	W104 M106 A113 I173 P174	W104-R109 HydrophobicContact CD2-CG 4.33Å; W104-R109 HydrophobicContact CG-CG 4.28Å; W104-R109 PolarHBondContact O-NE 2.87Å; W104-R109 PolarHBondContact O-NH2 3.45Å; M106-R109 PolarHBondContact O-N 2.98Å; R109-A113 HydrophobicContact CB-CB 3.58Å; R109-A113 HydrophobicContact CG-CB 3.76Å; R109-I173 PolarHBondContact NH1-O 2.87Å; R109-I173 PolarHBondContact NH2-O 2.91Å; R109-P174 PolarHBondContact NH2-O 3.36Å
110	G	95.4	Very high	98	Very high	30 Å²	30	31.9 Å²	31.9	31%	0.309	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.3	-147.3	-177.1	0	0	0	0	0	112.9	C145 W217	G110-C145 PolarHBondContact O-SG 3.2Å; G110-W217 VanDerWaalsContact CA-CE3 3.44Å
111	T	96.3	Very high	98	Very high	79 Å²	79	37.4 Å²	37.4	49%	0.485	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-25.3	-173.8	55.6	0	0	0	0	114.1
112	H	97.6	Very high	98	Very high	22 Å²	22	35.9 Å²	35.9	10%	0.102	19%	0.19	C	C	.	.			trans	-143.6	114.3	179.8	-59	89.1	0	0	0	109.4	Y129 T130 A131 D143 R146 V216	H112-Y129 PolarHBondContact CE1-O 3.05Å; H112-Y129 VanDerWaalsContact CE1-O 3.32Å; H112-T130 WeakPolarHBondContact CB-O 3.46Å; H112-A131 PolarHBondContact CD2-N 2.85Å; H112-D143 IonicContact CD2-OD2 2.69Å; H112-R146 PolarHBondContact NE2-NH2 3Å; H112-R146 VanDerWaalsContact NE2-NH2 3.14Å; H112-V216 HydrophobicContact CB-CG1 4.09Å; H112-V216 HydrophobicContact CB-CG2 4.44Å; H112-V216 WeakPolarHBondContact O-CG2 3.4Å
113	A	98.4	Very high	98	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	102.9	174.7	0	0	0	0	0	108	W104 R109 L144	W104-A113 HydrophobicContact CD2-CB 4.48Å; W104-A113 HydrophobicContact CE3-CB 4.36Å; W104-A113 HydrophobicContact CH2-CB 3.5Å; W104-A113 HydrophobicContact CZ2-CB 3.62Å; W104-A113 HydrophobicContact CZ3-CB 3.9Å; R109-A113 HydrophobicContact CB-CB 3.58Å; R109-A113 HydrophobicContact CG-CB 3.76Å; A113-L144 WeakPolarHBondContact O-CG 3.39Å; A113-L144 PolarHBondContact O-N 3.18Å
114	V	98.8	Very high	98	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	131.6	-171.1	-166.6	0	0	0	0	110.3	A131 V133 W142 D143 V213 S214	V114-A131 HydrophobicContact CG2-CB 3.89Å; V114-V133 HydrophobicContact CB-CB 4.14Å; V114-V133 HydrophobicContact CG1-CB 3.82Å; V114-V133 HydrophobicContact CG1-CG1 4.12Å; V114-V133 WeakPolarHBondContact CG1-O 3.33Å; V114-W142 WeakPolarHBondContact CA-O 3.38Å; V114-D143 HydrophobicContact CG2-CB 4.12Å; V114-V213 CarbonylContact O-C 3.53Å; V114-V213 WeakPolarHBondContact O-CA 3.3Å; V114-V213 WeakPolarHBondContact O-CB 3.23Å; V114-S214 WeakPolarHBondContact CB-OG 3.48Å; V114-S214 PolarHBondContact N-O 2.97Å; V114-S214 VanDerWaalsContact N-O 3.11Å; V114-S214 PolarHBondContact O-N 3.32Å
115	V	98.9	Very high	98	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.006	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	132.8	179.5	179.1	0	0	0	0	110.3	I102 W104 W142 L144 L177 V179 Y190 V213	I102-V115 HydrophobicContact CB-CG1 4.48Å; I102-V115 HydrophobicContact CG1-CG1 3.85Å; I102-V115 HydrophobicContact CG2-CG2 4.23Å; W104-V115 HydrophobicContact CE3-CG2 4.09Å; W104-V115 HydrophobicContact CZ3-CG2 4.19Å; V115-W142 PolarHBondContact N-O 3.05Å; V115-W142 PolarHBondContact O-N 3.41Å; V115-L144 HydrophobicContact CG2-CD1 3.82Å; V115-L144 HydrophobicContact CG2-CD2 4.28Å; V115-L144 HydrophobicContact CG2-CG 4.18Å; V115-L177 HydrophobicContact CG1-CD1 4.46Å; V115-V179 HydrophobicContact CG1-CG2 3.67Å; V115-Y190 HydrophobicContact CG1-CE1 4.38Å; V115-Y190 PolarHBondContact O-OH 3.23Å; V115-V213 HydrophobicContact CB-CG1 4.3Å; V115-V213 HydrophobicContact CG1-CG1 4.21Å; V115-V213 HydrophobicContact CG2-CG1 3.93Å
116	G	98.8	Very high	98	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.7	-136	172.2	0	0	0	0	0	114	W140 I212	G116-W140 VanDerWaalsContact CA-O 3.3Å; G116-W140 WeakPolarHBondContact CA-O 3.43Å; G116-I212 CarbonylContact C-O 3.54Å; G116-I212 PolarHBondContact N-O 3.34Å; G116-I212 PolarHBondContact O-N 3.25Å; G116-I212 VanDerWaalsContact O-O 3.14Å
117	V	98.9	Very high	98.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	152.8	-177.7	-58.7	0	0	0	0	111.5	W100 S139 W140 L181 L188 L204 L209 Y210	W100-V117 HydrophobicContact CH2-CG1 3.74Å; W100-V117 HydrophobicContact CZ2-CG1 3.85Å; V117-S139 WeakPolarHBondContact O-CA 3.47Å; V117-W140 HydrophobicContact CG2-CB 4.25Å; V117-W140 HydrophobicContact CG2-CE3 4.01Å; V117-W140 PolarHBondContact N-O 3.1Å; V117-W140 PolarHBondContact O-N 3.12Å; V117-L181 HydrophobicContact CG1-CD1 4.32Å; V117-L181 HydrophobicContact CG1-CD2 4.27Å; V117-L188 HydrophobicContact CG1-CD1 3.93Å; V117-L188 HydrophobicContact CG1-CD2 4.34Å; V117-L188 HydrophobicContact CG2-CD2 3.96Å; V117-L204 HydrophobicContact CG2-CD1 4.5Å; V117-L209 HydrophobicContact CB-CB 4.23Å; V117-L209 HydrophobicContact CG2-CB 4.41Å; V117-L209 HydrophobicContact CG2-CD1 3.92Å; V117-Y210 CarbonylContact C-O 3.48Å; V117-Y210 WeakPolarHBondContact CA-O 3.3Å
118	G	98.8	Very high	98.2	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	160.4	176.7	0	0	0	0	0	112.8	E138 Y210	G118-E138 CarbonylContact C-O 3.42Å; G118-E138 VanDerWaalsContact CA-O 3.27Å; G118-E138 WeakPolarHBondContact CA-O 3.34Å; G118-Y210 PolarHBondContact N-O 3.41Å; G118-Y210 PolarHBondContact O-N 2.83Å
119	T	98.9	Very high	98.2	Very high	14 Å²	14	36.1 Å²	36.1	9%	0.086	21%	0.211	C	C	.	.			trans	-74	174.5	169.1	70	0	0	0	0	110.1	R88 D121 A122 E138 W140 L209	R88-T119 PolarHBondContact NH1-O 2.84Å; T119-D121 PolarHBondContact O-N 2.77Å; T119-D121 PolarHBondContact OG1-N 3.12Å; T119-A122 PolarHBondContact O-N 3.26Å; T119-A122 PolarHBondContact OG1-N 2.89Å; T119-E138 WeakPolarHBondContact CG2-OE2 3.29Å; T119-E138 PolarHBondContact N-O 3.38Å; T119-E138 WeakPolarHBondContact OG1-CB 3.49Å; T119-E138 PolarHBondContact OG1-O 3.43Å; T119-E138 PolarHBondContact OG1-OE2 2.72Å; T119-W140 HydrophobicContact CG2-CH2 4.49Å; T119-W140 HydrophobicContact CG2-CZ3 4.28Å; T119-L209 HydrophobicContact CG2-CD2 4.04Å
120	S	98.5	Very high	98.2	Very high	64 Å²	64	37.9 Å²	37.9	45%	0.448	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-22.9	169.9	49.1	0	0	0	0	112.9	R88	R88-S120 VanDerWaalsContact CZ-O 3.29Å; R88-S120 PolarHBondContact NH1-O 2.82Å; R88-S120 VanDerWaalsContact NH1-O 3.12Å; R88-S120 PolarHBondContact NH2-O 3.36Å; R88-S120 VanDerWaalsContact NH2-O 3.08Å
121	D	98.7	Very high	98.3	Very high	118 Å²	118	37.3 Å²	37.3	63%	0.631	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94	-8.4	-170.7	-52.7	-23.5	0	0	0	111.8	T119 E138	T119-D121 PolarHBondContact O-N 2.77Å; T119-D121 PolarHBondContact OG1-N 3.12Å; D121-E138 HydrophobicContact CB-CG 4.23Å
122	A	98.6	Very high	98.4	Very high	4 Å²	4	33.9 Å²	33.9	3%	0.033	19%	0.194	C	C	.	.	S	Bend	trans	-59.6	129.5	172.2	0	0	0	0	0	110.6	R88 T119 E138 I212	R88-A122 PolarHBondContact NH1-O 2.85Å; T119-A122 PolarHBondContact O-N 3.26Å; T119-A122 PolarHBondContact OG1-N 2.89Å; A122-E138 HydrophobicContact CB-CB 3.93Å; A122-I212 HydrophobicContact CB-CD1 4.4Å
123	P	98.5	Very high	98.4	Very high	53 Å²	53	32.9 Å²	32.9	34%	0.344	19%	0.19	S	C	.	.			trans	-68	141.2	178.8	27.7	-34.1	0	0	0	110.7	L132 N136	P123-L132 HydrophobicContact CG-CD1 4.01Å; P123-N136 VanDerWaalsContact CD-ND2 3.26Å; P123-N136 WeakPolarHBondContact CD-ND2 3.38Å
124	L	98.8	Very high	98.4	Very high	20 Å²	20	32.9 Å²	32.9	11%	0.105	19%	0.19	C	C	.	.	S	Bend	trans	-100.8	1	-178.4	-60.8	-174.7	0	0	0	114.3	D60 S62 A86 R88 I212	D60-L124 VanDerWaalsContact C-CD1 3.42Å; D60-L124 WeakPolarHBondContact O-CD1 3.4Å; D60-L124 VanDerWaalsContact OD1-CD1 3.31Å; D60-L124 WeakPolarHBondContact OD1-CD1 3.39Å; S62-L124 WeakPolarHBondContact CB-O 3.05Å; A86-L124 HydrophobicContact CB-CB 4.38Å; A86-L124 HydrophobicContact CB-CD2 3.98Å; A86-L124 PolarHBondContact N-O 3.49Å; R88-L124 HydrophobicContact CG-CD2 4.17Å; L124-I212 HydrophobicContact CD2-CD1 3.56Å; L124-I212 HydrophobicContact CD2-CG1 4.29Å
125	H	98.8	Very high	98.4	Very high	86 Å²	86	33.6 Å²	33.6	40%	0.398	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	147.9	178	173.4	74.9	0	0	0	110.7	S83 T84 D85	S83-H125 PolarHBondContact OG-CE1 2.94Å; S83-H125 PolarHBondContact OG-ND1 2.77Å; T84-H125 WeakPolarHBondContact O-CA 3.45Å; T84-H125 PolarHBondContact O-ND1 3.15Å; D85-H125 IonicContact OD1-CE1 2.91Å; D85-H125 IonicContact OD1-ND1 3.51Å; D85-H125 PolarHBondContact OD1-ND1 3.33Å
126	S	98.4	Very high	98.4	Very high	38 Å²	38	35.3 Å²	35.3	27%	0.266	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	145.6	167.3	-178.8	0	0	0	0	110.3	T84	T84-S126 PolarHBondContact N-O 3.44Å; T84-S126 PolarHBondContact O-N 3.42Å
127	V	98.1	Very high	98.3	Very high	117 Å²	117	38.1 Å²	38.1	71%	0.709	22%	0.224	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-68.8	143.7	166.7	-178	0	0	0	0	109.2
128	G	97.9	Very high	98.3	Very high	12 Å²	12	40.6 Å²	40.6	12%	0.124	24%	0.235	C	C	.	.	S	Bend	trans	81.4	176.8	-176.3	0	0	0	0	0	113.6	Q82 S83 T84	Q82-G128 PolarHBondContact O-N 2.97Å; S83-G128 CarbonylContact C-O 3.53Å; T84-G128 PolarHBondContact N-O 3.03Å; T84-G128 PolarHBondContact OG1-O 3.33Å
129	Y	98	Very high	98.3	Very high	90 Å²	90	40.7 Å²	40.7	35%	0.353	24%	0.236	S	C	.	.	S	Bend	trans	-96.4	109.5	174.6	-55.5	-45.2	0	0	0	109.9	Q82 H112 V216	Q82-Y129 VanDerWaalsContact N-CZ 3.32Å; Q82-Y129 PolarHBondContact N-OH 3.28Å; H112-Y129 PolarHBondContact CE1-O 3.05Å; H112-Y129 VanDerWaalsContact CE1-O 3.32Å; Y129-V216 HydrophobicContact CD1-CB 3.77Å; Y129-V216 HydrophobicContact CD1-CG1 3.96Å; Y129-V216 HydrophobicContact CE1-CB 4.39Å; Y129-V216 HydrophobicContact CG-CB 4.43Å; Y129-V216 HydrophobicContact CG-CG1 4.48Å
130	T	97.1	Very high	98.3	Very high	47 Å²	47	40.4 Å²	40.4	29%	0.288	23%	0.233	S	C	.	.			trans	-139.4	158.7	-171.2	65.2	0	0	0	0	111.4	T84 H112 L132	T84-T130 WeakPolarHBondContact CG2-O 3.27Å; T84-T130 PolarHBondContact OG1-N 3.17Å; T84-T130 PolarHBondContact OG1-OG1 3.25Å; H112-T130 WeakPolarHBondContact CB-O 3.46Å; T130-L132 VanDerWaalsContact C-N 3.27Å; T130-L132 PolarHBondContact O-N 3.28Å; T130-L132 VanDerWaalsContact O-N 3.07Å
131	A	97	Very high	98.3	Very high	19 Å²	19	37.3 Å²	37.3	16%	0.157	21%	0.212	C	C	.	.			trans	-77.7	79	162.8	0	0	0	0	0	109.3	H112 V114 S135 Y150	H112-A131 PolarHBondContact CD2-N 2.85Å; V114-A131 HydrophobicContact CG2-CB 3.89Å; A131-S135 WeakPolarHBondContact O-CB 3.38Å; A131-Y150 HydrophobicContact CB-CD2 4.16Å; A131-Y150 HydrophobicContact CB-CE2 4.22Å
132	L	98.6	Very high	98.3	Very high	6 Å²	6	31.7 Å²	31.7	3%	0.031	18%	0.182	C	C	.	.			trans	-65.3	-50.2	-173.3	173.9	60.6	0	0	0	112.4	T84 A86 P123 T130 G134 S135	T84-L132 HydrophobicContact CG2-CB 3.53Å; T84-L132 HydrophobicContact CG2-CD2 4.16Å; A86-L132 HydrophobicContact CB-CD2 4.14Å; P123-L132 HydrophobicContact CG-CD1 4.01Å; T130-L132 VanDerWaalsContact C-N 3.27Å; T130-L132 PolarHBondContact O-N 3.28Å; T130-L132 VanDerWaalsContact O-N 3.07Å; L132-G134 PolarHBondContact O-N 3.33Å; L132-S135 VanDerWaalsContact O-CB 3.23Å; L132-S135 WeakPolarHBondContact O-CB 3.4Å; L132-S135 PolarHBondContact O-N 2.86Å; L132-S135 VanDerWaalsContact O-N 3.1Å; L132-S135 PolarHBondContact O-OG 3.45Å
133	V	98.8	Very high	98.3	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.006	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	127.4	171.6	176.5	0	0	0	0	108.4	V114 I212 S214	V114-V133 HydrophobicContact CB-CB 4.14Å; V114-V133 HydrophobicContact CG1-CB 3.82Å; V114-V133 HydrophobicContact CG1-CG1 4.12Å; V114-V133 WeakPolarHBondContact CG1-O 3.33Å; V133-I212 HydrophobicContact CG1-CG2 3.76Å; V133-I212 HydrophobicContact CG2-CB 4.48Å; V133-I212 HydrophobicContact CG2-CD1 3.94Å; V133-I212 HydrophobicContact CG2-CG1 3.85Å; V133-I212 HydrophobicContact CG2-CG2 3.93Å; V133-S214 PolarHBondContact N-OG 3.48Å
134	G	98.6	Very high	98.2	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.3	-3	-174.5	0	0	0	0	0	114.7	L132 N136 S139 Y150 H151 D152 G153	L132-G134 PolarHBondContact O-N 3.33Å; G134-N136 VanDerWaalsContact C-N 3.27Å; G134-N136 PolarHBondContact O-N 3.08Å; G134-S139 PolarHBondContact N-OG 2.84Å; G134-Y150 VanDerWaalsContact CA-O 3.25Å; G134-Y150 WeakPolarHBondContact CA-O 3.45Å; G134-Y150 CarbonylContact O-C 3.59Å; G134-H151 CarbonylContact O-C 3.53Å; G134-H151 VanDerWaalsContact O-CA 3.29Å; G134-H151 WeakPolarHBondContact O-CA 3.41Å; G134-H151 PolarHBondContact O-N 2.79Å; G134-D152 PolarHBondContact O-N 2.96Å; G134-D152 VanDerWaalsContact O-N 3.12Å; G134-G153 PolarHBondContact O-N 2.94Å
135	S	98.2	Very high	97.9	Very high	16 Å²	16	30.2 Å²	30.2	11%	0.112	17%	0.173	C	C	.	.	S	Bend	trans	-71.1	-18.6	-179.2	65.1	0	0	0	0	114.4	A131 L132 G153 K154	A131-S135 WeakPolarHBondContact O-CB 3.38Å; L132-S135 VanDerWaalsContact O-CB 3.23Å; L132-S135 WeakPolarHBondContact O-CB 3.4Å; L132-S135 PolarHBondContact O-N 2.86Å; L132-S135 VanDerWaalsContact O-N 3.1Å; L132-S135 PolarHBondContact O-OG 3.45Å; S135-G153 PolarHBondContact O-N 2.74Å; S135-K154 VanDerWaalsContact O-CG 3.3Å; S135-K154 WeakPolarHBondContact O-CG 3.49Å; S135-K154 PolarHBondContact O-N 3.49Å; S135-K154 VanDerWaalsContact O-N 3.13Å
136	N	98	Very high	97.6	Very high	36 Å²	36	32 Å²	32	19%	0.193	18%	0.177	C	C	.	.	S	Bend	trans	-137.5	-176.7	-179.3	67.7	3.7	0	0	0	111.2	P123 G134 E138 S139 D152	P123-N136 VanDerWaalsContact CD-ND2 3.26Å; P123-N136 WeakPolarHBondContact CD-ND2 3.38Å; G134-N136 VanDerWaalsContact C-N 3.27Å; G134-N136 PolarHBondContact O-N 3.08Å; N136-E138 PolarHBondContact O-N 3.48Å; N136-E138 PolarHBondContact OD1-N 2.92Å; N136-E138 VanDerWaalsContact OD1-N 3.1Å; N136-S139 PolarHBondContact OD1-OG 2.69Å; N136-D152 WeakPolarHBondContact O-CA 3.39Å; N136-D152 PolarHBondContact O-N 3.12Å
137	S	98.1	Very high	97.5	Very high	59 Å²	59	30.2 Å²	30.2	41%	0.413	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-13.7	178.4	57.2	0	0	0	0	114.9	H151	S137-H151 PolarHBondContact O-CE1 2.84Å
138	E	98.7	Very high	97.4	Very high	52 Å²	52	27.3 Å²	27.3	24%	0.243	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-4.6	-171.7	-62.1	-45.4	120.4	0	0	113.4	G118 T119 D121 A122 N136	G118-E138 CarbonylContact C-O 3.42Å; G118-E138 VanDerWaalsContact CA-O 3.27Å; G118-E138 WeakPolarHBondContact CA-O 3.34Å; T119-E138 WeakPolarHBondContact CG2-OE2 3.29Å; T119-E138 PolarHBondContact N-O 3.38Å; T119-E138 WeakPolarHBondContact OG1-CB 3.49Å; T119-E138 PolarHBondContact OG1-O 3.43Å; T119-E138 PolarHBondContact OG1-OE2 2.72Å; D121-E138 HydrophobicContact CB-CG 4.23Å; A122-E138 HydrophobicContact CB-CB 3.93Å; N136-E138 PolarHBondContact O-N 3.48Å; N136-E138 PolarHBondContact OD1-N 2.92Å; N136-E138 VanDerWaalsContact OD1-N 3.1Å
139	S	98.8	Very high	97.4	Very high	2 Å²	2	27.2 Å²	27.2	1%	0.014	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	157.7	-178.9	53.8	0	0	0	0	113.4	V117 G134 N136 H151	V117-S139 WeakPolarHBondContact O-CA 3.47Å; G134-S139 PolarHBondContact N-OG 2.84Å; N136-S139 PolarHBondContact OD1-OG 2.69Å; S139-H151 PolarHBondContact O-ND1 3.13Å
140	W	98.9	Very high	97.4	Very high	8 Å²	8	24.7 Å²	24.7	3%	0.03	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	122	179.4	-61.1	-96.6	0	0	0	107.5	G116 V117 T119 H151 L188 F201 L204 K207 L209	G116-W140 VanDerWaalsContact CA-O 3.3Å; G116-W140 WeakPolarHBondContact CA-O 3.43Å; V117-W140 HydrophobicContact CG2-CB 4.25Å; V117-W140 HydrophobicContact CG2-CE3 4.01Å; V117-W140 PolarHBondContact N-O 3.1Å; V117-W140 PolarHBondContact O-N 3.12Å; T119-W140 HydrophobicContact CG2-CH2 4.49Å; T119-W140 HydrophobicContact CG2-CZ3 4.28Å; W140-H151 AromaticContact CD1-CE1 3.95Å; W140-H151 AromaticContact CD1-CG 3.38Å; W140-H151 AromaticContact CD1-ND1 3.37Å; W140-H151 AromaticContact CD2-ND1 3.89Å; W140-H151 AromaticContact CE2-CE1 3.32Å; W140-H151 AromaticContact CE2-ND1 3.4Å; W140-H151 AromaticContact CE2-NE2 3.97Å; W140-H151 HydrophobicContact CG-CB 4.36Å; W140-H151 AromaticContact CG-ND1 3.86Å; W140-H151 AromaticContact CZ2-CE1 3.41Å; W140-H151 VanDerWaalsContact CZ2-CE1 3.41Å; W140-H151 WeakPolarHBondContact CZ2-CE1 3.34Å; W140-H151 AromaticContact CZ2-ND1 3.94Å; W140-H151 AromaticContact NE1-CD2 3.57Å; W140-H151 AromaticContact NE1-CE1 3.17Å; W140-H151 PolarHBondContact NE1-CE1 3.1Å; W140-H151 AromaticContact NE1-CG 3.31Å; W140-H151 VanDerWaalsContact NE1-CG 3.31Å; W140-H151 AromaticContact NE1-ND1 3.08Å; W140-H151 PolarHBondContact NE1-ND1 3.41Å; W140-H151 AromaticContact NE1-NE2 3.45Å; W140-H151 PolarHBondContact NE1-NE2 3.37Å; W140-L188 HydrophobicContact CB-CD2 4.44Å; W140-F201 HydrophobicContact CB-CD1 4.16Å; W140-F201 HydrophobicContact CB-CD2 3.96Å; W140-F201 HydrophobicContact CB-CE1 4.2Å; W140-F201 HydrophobicContact CB-CE2 3.98Å; W140-F201 HydrophobicContact CB-CG 4Å; W140-F201 HydrophobicContact CB-CZ 4.09Å; W140-F201 AromaticContact CD1-CD1 3.55Å; W140-F201 AromaticContact CD1-CG 3.82Å; W140-F201 HydrophobicContact CG-CD1 4.25Å; W140-F201 HydrophobicContact CG-CG 4.25Å; W140-L204 HydrophobicContact CD2-CD2 3.54Å; W140-L204 HydrophobicContact CE3-CD2 4.05Å; W140-L204 HydrophobicContact CG-CD2 3.96Å; W140-L204 HydrophobicContact CH2-CD2 4.36Å; W140-L204 HydrophobicContact CZ2-CD2 3.83Å; W140-L204 HydrophobicContact CZ3-CD2 4.44Å; W140-K207 HydrophobicContact CH2-CD 3.56Å; W140-K207 HydrophobicContact CZ2-CD 4.06Å; W140-K207 HydrophobicContact CZ3-CD 4.31Å; W140-L209 HydrophobicContact CE3-CD2 4.11Å; W140-L209 HydrophobicContact CH2-CD2 4.26Å; W140-L209 HydrophobicContact CZ3-CD2 3.49Å; W140-L209 VanDerWaalsContact CZ3-CD2 3.49Å
141	G	98.7	Very high	97.5	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	143.7	-170.8	0	0	0	0	0	114	L149 Y150 F201	G141-L149 CarbonylContact O-C 3.58Å; G141-L149 WeakPolarHBondContact O-CA 3.43Å; G141-Y150 PolarHBondContact N-O 2.9Å; G141-Y150 PolarHBondContact O-N 3.31Å; G141-F201 WeakPolarHBondContact O-CZ 3.47Å
142	W	98.6	Very high	97.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	115.9	168.1	-177.5	27.8	0	0	0	109.7	V114 V115 L144 L149 Y161 F171 I173 L177 Y190 V192 L197	V114-W142 WeakPolarHBondContact CA-O 3.38Å; V115-W142 PolarHBondContact N-O 3.05Å; V115-W142 PolarHBondContact O-N 3.41Å; W142-L144 HydrophobicContact CD2-CD2 3.92Å; W142-L144 HydrophobicContact CE3-CD2 3.73Å; W142-L144 HydrophobicContact CG-CD2 4.38Å; W142-L144 HydrophobicContact CZ3-CD2 4.19Å; W142-L144 PolarHBondContact O-N 2.96Å; W142-L149 HydrophobicContact CB-CD2 3.67Å; W142-L149 HydrophobicContact CG-CD2 3.81Å; W142-Y161 AromaticContact CD2-CD1 3.93Å; W142-Y161 HydrophobicContact CD2-CD1 3.93Å; W142-Y161 HydrophobicContact CD2-CE1 4.16Å; W142-Y161 AromaticContact CE2-CD1 3.5Å; W142-Y161 HydrophobicContact CE3-CD1 4.48Å; W142-Y161 HydrophobicContact CE3-CE1 4.25Å; W142-Y161 HydrophobicContact CG-CD1 4.34Å; W142-Y161 HydrophobicContact CH2-CD1 4.26Å; W142-Y161 HydrophobicContact CH2-CE1 4.06Å; W142-Y161 AromaticContact CZ2-CD1 3.68Å; W142-Y161 HydrophobicContact CZ2-CD1 3.68Å; W142-Y161 AromaticContact CZ2-CE1 3.96Å; W142-Y161 HydrophobicContact CZ2-CE1 3.96Å; W142-Y161 HydrophobicContact CZ3-CE1 4.2Å; W142-Y161 AromaticContact NE1-CD1 3.66Å; W142-Y161 PolarHBondContact NE1-O 3.22Å; W142-F171 HydrophobicContact CH2-CD1 4.48Å; W142-F171 HydrophobicContact CZ2-CD1 4.37Å; W142-I173 HydrophobicContact CD2-CD1 4.45Å; W142-I173 HydrophobicContact CH2-CD1 3.47Å; W142-I173 VanDerWaalsContact CH2-CD1 3.47Å; W142-I173 HydrophobicContact CH2-CG1 3.79Å; W142-I173 HydrophobicContact CZ2-CD1 3.32Å; W142-I173 HydrophobicContact CZ2-CG1 3.97Å; W142-I173 HydrophobicContact CZ3-CD1 4.09Å; W142-L177 HydrophobicContact CE3-CD1 4.27Å; W142-L177 HydrophobicContact CZ3-CD1 4.12Å; W142-Y190 HydrophobicContact CB-CD2 4.49Å; W142-Y190 HydrophobicContact CB-CE1 4.22Å; W142-Y190 HydrophobicContact CB-CE2 3.71Å; W142-Y190 WeakPolarHBondContact CB-OH 3.25Å; W142-Y190 HydrophobicContact CD2-CD2 4.26Å; W142-Y190 HydrophobicContact CD2-CE2 4.33Å; W142-Y190 HydrophobicContact CD2-CG 4.47Å; W142-Y190 AromaticContact CE3-CD1 3.67Å; W142-Y190 HydrophobicContact CE3-CD1 3.67Å; W142-Y190 AromaticContact CE3-CD2 3.69Å; W142-Y190 HydrophobicContact CE3-CD2 3.69Å; W142-Y190 AromaticContact CE3-CE1 3.98Å; W142-Y190 HydrophobicContact CE3-CE1 3.98Å; W142-Y190 HydrophobicContact CE3-CE2 4.04Å; W142-Y190 AromaticContact CE3-CG 3.49Å; W142-Y190 HydrophobicContact CE3-CG 3.49Å; W142-Y190 VanDerWaalsContact CE3-CG 3.49Å; W142-Y190 HydrophobicContact CG-CE2 4.26Å; W142-Y190 HydrophobicContact CZ3-CD1 4.14Å; W142-Y190 HydrophobicContact CZ3-CD2 4.26Å; W142-Y190 AromaticContact CZ3-CG 3.78Å; W142-Y190 HydrophobicContact CZ3-CG 3.78Å; W142-Y190 PolarHBondContact N-OH 3.08Å; W142-V192 HydrophobicContact CH2-CG2 4.02Å; W142-V192 HydrophobicContact CZ3-CG2 4.14Å; W142-L197 HydrophobicContact CH2-CD1 3.69Å; W142-L197 HydrophobicContact CZ3-CD1 4.24Å
143	D	97.9	Very high	97.3	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	107.7	171.9	-173.6	-22.2	0	0	0	109.2	H112 V114 C145 R146 S147 K148 Y150	H112-D143 IonicContact CD2-OD2 2.69Å; V114-D143 HydrophobicContact CG2-CB 4.12Å; D143-C145 PolarHBondContact O-N 3.26Å; D143-C145 PolarHBondContact OD1-N 3.46Å; D143-R146 HydrophobicContact CB-CB 4.41Å; D143-R146 PolarHBondContact O-N 2.91Å; D143-R146 PolarHBondContact OD1-N 3.43Å; D143-R146 WeakPolarHBondContact OD2-CD 3.47Å; D143-R146 IonicContact OD2-NE 2.94Å; D143-S147 PolarHBondContact O-N 3.36Å; D143-K148 PolarHBondContact N-O 2.81Å; D143-K148 PolarHBondContact O-N 3.33Å; D143-Y150 HydrophobicContact CB-CD2 3.99Å; D143-Y150 HydrophobicContact CB-CE2 3.62Å
144	L	96.6	Very high	97	Very high	4 Å²	4	35.3 Å²	35.3	2%	0.021	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-25.6	-174.9	-54	-176.2	0	0	0	112.4	W104 A113 V115 W142 I173 L177	W104-L144 HydrophobicContact CE3-CD1 4.42Å; A113-L144 WeakPolarHBondContact O-CG 3.39Å; A113-L144 PolarHBondContact O-N 3.18Å; V115-L144 HydrophobicContact CG2-CD1 3.82Å; V115-L144 HydrophobicContact CG2-CD2 4.28Å; V115-L144 HydrophobicContact CG2-CG 4.18Å; W142-L144 HydrophobicContact CD2-CD2 3.92Å; W142-L144 HydrophobicContact CE3-CD2 3.73Å; W142-L144 HydrophobicContact CG-CD2 4.38Å; W142-L144 HydrophobicContact CZ3-CD2 4.19Å; W142-L144 PolarHBondContact O-N 2.96Å; L144-I173 HydrophobicContact CB-CD1 3.74Å; L144-I173 HydrophobicContact CD2-CD1 3.66Å; L144-I173 HydrophobicContact CD2-CG2 4.5Å; L144-I173 HydrophobicContact CG-CD1 4.26Å; L144-I173 WeakPolarHBondContact O-CD1 3.36Å; L144-L177 HydrophobicContact CD1-CD2 4.02Å; L144-L177 HydrophobicContact CD2-CD1 4.47Å; L144-L177 HydrophobicContact CD2-CD2 4.25Å
145	C	92.9	Very high	96.8	Very high	42 Å²	42	41 Å²	41	28%	0.284	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-25.7	-177.9	-64.3	0	0	0	0	112.3	G110 D143	G110-C145 PolarHBondContact O-SG 3.2Å; D143-C145 PolarHBondContact O-N 3.26Å; D143-C145 PolarHBondContact OD1-N 3.46Å
146	R	92.6	Very high	96.7	Very high	124 Å²	124	44.7 Å²	44.7	47%	0.468	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.7	-5.7	-175	-61.8	-179.1	-176.4	-109.6	7.9	113.6	H112 D143 K148	H112-R146 PolarHBondContact NE2-NH2 3Å; H112-R146 VanDerWaalsContact NE2-NH2 3.14Å; D143-R146 HydrophobicContact CB-CB 4.41Å; D143-R146 PolarHBondContact O-N 2.91Å; D143-R146 PolarHBondContact OD1-N 3.43Å; D143-R146 WeakPolarHBondContact OD2-CD 3.47Å; D143-R146 IonicContact OD2-NE 2.94Å; R146-K148 HydrophobicContact CB-CB 4.35Å; R146-K148 HydrophobicContact CB-CG 4.47Å; R146-K148 PolarHBondContact O-N 3.34Å
147	S	94.6	Very high	96.5	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.6	41.4	-173.2	-56.4	0	0	0	0	111.7	D143 T160 Y161 F171	D143-S147 PolarHBondContact O-N 3.36Å; S147-T160 WeakPolarHBondContact O-CA 3.41Å; S147-Y161 CarbonylContact C-O 3.58Å; S147-Y161 WeakPolarHBondContact CB-O 3.28Å; S147-Y161 PolarHBondContact O-N 2.93Å; S147-Y161 VanDerWaalsContact O-O 3.07Å; S147-F171 WeakPolarHBondContact OG-CB 3.18Å; S147-F171 PolarHBondContact OG-N 3.17Å
148	K	96.2	Very high	96.3	Very high	56 Å²	56	47 Å²	47	24%	0.243	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	137	-177.7	-76.3	-174.5	-174.9	-174.4	0	112.4	D143 R146 Y150 K159	D143-K148 PolarHBondContact N-O 2.81Å; D143-K148 PolarHBondContact O-N 3.33Å; R146-K148 HydrophobicContact CB-CB 4.35Å; R146-K148 HydrophobicContact CB-CG 4.47Å; R146-K148 PolarHBondContact O-N 3.34Å; K148-Y150 HydrophobicContact CB-CE2 3.8Å; K148-K159 CarbonylContact C-O 3.54Å; K148-K159 WeakPolarHBondContact CA-O 3.3Å
149	L	98.1	Very high	96.2	Very high	9 Å²	9	51.4 Å²	51.4	5%	0.047	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	132.6	172.3	-59.8	178.3	0	0	0	109.7	G141 W142 G158 K159 Y161 Y190 A200 F201	G141-L149 CarbonylContact O-C 3.58Å; G141-L149 WeakPolarHBondContact O-CA 3.43Å; W142-L149 HydrophobicContact CB-CD2 3.67Å; W142-L149 HydrophobicContact CG-CD2 3.81Å; L149-G158 CarbonylContact O-C 3.55Å; L149-G158 VanDerWaalsContact O-CA 3.22Å; L149-G158 WeakPolarHBondContact O-CA 3.38Å; L149-K159 HydrophobicContact CB-CB 4.44Å; L149-K159 PolarHBondContact N-O 3.38Å; L149-K159 PolarHBondContact O-N 2.85Å; L149-Y161 HydrophobicContact CD1-CD2 3.74Å; L149-Y161 HydrophobicContact CD1-CG 3.88Å; L149-Y161 HydrophobicContact CD2-CD1 4.2Å; L149-Y161 HydrophobicContact CD2-CD2 4.43Å; L149-Y161 HydrophobicContact CD2-CG 3.93Å; L149-Y161 VanDerWaalsContact CG-CB 3.47Å; L149-Y161 HydrophobicContact CG-CD2 4.32Å; L149-Y161 HydrophobicContact CG-CG 3.94Å; L149-Y190 HydrophobicContact CD2-CE2 4.28Å; L149-A200 HydrophobicContact CD1-CB 3.64Å; L149-A200 WeakPolarHBondContact CD1-O 3.24Å; L149-A200 HydrophobicContact CD2-CB 3.79Å; L149-A200 HydrophobicContact CG-CB 4.37Å; L149-F201 HydrophobicContact CB-CE1 3.93Å; L149-F201 HydrophobicContact CB-CE2 4.29Å; L149-F201 HydrophobicContact CB-CZ 3.58Å; L149-F201 HydrophobicContact CD1-CZ 4.48Å; L149-F201 HydrophobicContact CD2-CE2 3.79Å; L149-F201 HydrophobicContact CD2-CZ 3.94Å; L149-F201 HydrophobicContact CG-CE2 4.41Å; L149-F201 HydrophobicContact CG-CZ 4.18Å
150	Y	98.5	Very high	96	Very high	38 Å²	38	52.9 Å²	52.9	15%	0.149	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	133.4	176.3	-63.2	-76.6	0	0	0	110.7	A131 G134 G141 D143 K148 G158 F201	A131-Y150 HydrophobicContact CB-CD2 4.16Å; A131-Y150 HydrophobicContact CB-CE2 4.22Å; G134-Y150 VanDerWaalsContact CA-O 3.25Å; G134-Y150 WeakPolarHBondContact CA-O 3.45Å; G134-Y150 CarbonylContact O-C 3.59Å; G141-Y150 PolarHBondContact N-O 2.9Å; G141-Y150 PolarHBondContact O-N 3.31Å; D143-Y150 HydrophobicContact CB-CD2 3.99Å; D143-Y150 HydrophobicContact CB-CE2 3.62Å; K148-Y150 HydrophobicContact CB-CE2 3.8Å; Y150-G158 VanDerWaalsContact CE1-CA 3.5Å; Y150-F201 WeakPolarHBondContact O-CZ 3.4Å
151	H	98.4	Very high	95.8	Very high	61 Å²	61	52.9 Å²	52.9	28%	0.282	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	129.5	166.3	170.6	60.8	0	0	0	106.5	G134 S137 S139 W140 G153 F201	G134-H151 CarbonylContact O-C 3.53Å; G134-H151 VanDerWaalsContact O-CA 3.29Å; G134-H151 WeakPolarHBondContact O-CA 3.41Å; G134-H151 PolarHBondContact O-N 2.79Å; S137-H151 PolarHBondContact O-CE1 2.84Å; S139-H151 PolarHBondContact O-ND1 3.13Å; W140-H151 AromaticContact CD1-CE1 3.95Å; W140-H151 AromaticContact CD1-CG 3.38Å; W140-H151 AromaticContact CD1-ND1 3.37Å; W140-H151 AromaticContact CD2-ND1 3.89Å; W140-H151 AromaticContact CE2-CE1 3.32Å; W140-H151 AromaticContact CE2-ND1 3.4Å; W140-H151 AromaticContact CE2-NE2 3.97Å; W140-H151 HydrophobicContact CG-CB 4.36Å; W140-H151 AromaticContact CG-ND1 3.86Å; W140-H151 AromaticContact CZ2-CE1 3.41Å; W140-H151 VanDerWaalsContact CZ2-CE1 3.41Å; W140-H151 WeakPolarHBondContact CZ2-CE1 3.34Å; W140-H151 AromaticContact CZ2-ND1 3.94Å; W140-H151 AromaticContact NE1-CD2 3.57Å; W140-H151 AromaticContact NE1-CE1 3.17Å; W140-H151 PolarHBondContact NE1-CE1 3.1Å; W140-H151 AromaticContact NE1-CG 3.31Å; W140-H151 VanDerWaalsContact NE1-CG 3.31Å; W140-H151 AromaticContact NE1-ND1 3.08Å; W140-H151 PolarHBondContact NE1-ND1 3.41Å; W140-H151 AromaticContact NE1-NE2 3.45Å; W140-H151 PolarHBondContact NE1-NE2 3.37Å; H151-G153 PolarHBondContact O-N 3.36Å; H151-F201 HydrophobicContact CB-CD1 4.26Å; H151-F201 HydrophobicContact CB-CE1 3.85Å
152	D	97.4	Very high	95.5	Very high	39 Å²	39	52.9 Å²	52.9	21%	0.209	27%	0.273	C	S	.	.	S	Bend	trans	50.5	38.9	-168.3	-162.1	33.2	0	0	0	113.3	G134 N136 K154 N155 L156	G134-D152 PolarHBondContact O-N 2.96Å; G134-D152 VanDerWaalsContact O-N 3.12Å; N136-D152 WeakPolarHBondContact O-CA 3.39Å; N136-D152 PolarHBondContact O-N 3.12Å; D152-K154 PolarHBondContact O-N 2.98Å; D152-N155 VanDerWaalsContact CG-ND2 3.26Å; D152-N155 PolarHBondContact O-N 2.79Å; D152-N155 PolarHBondContact OD1-ND2 2.88Å; D152-N155 WeakPolarHBondContact OD2-CB 3.48Å; D152-N155 PolarHBondContact OD2-ND2 2.87Å; D152-L156 HydrophobicContact CB-CD1 4.13Å; D152-L156 HydrophobicContact CB-CG 4.4Å; D152-L156 PolarHBondContact O-N 3.03Å
153	G	95.2	Very high	95	Very high	27 Å²	27	56.7 Å²	56.7	28%	0.278	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-12.7	-169.6	0	0	0	0	0	115.7	G134 S135 H151 N155 L156	G134-G153 PolarHBondContact O-N 2.94Å; S135-G153 PolarHBondContact O-N 2.74Å; H151-G153 PolarHBondContact O-N 3.36Å; G153-N155 VanDerWaalsContact C-N 3.32Å; G153-L156 CarbonylContact C-O 3.41Å; G153-L156 WeakPolarHBondContact CA-O 3.49Å
154	K	91.7	Very high	94.3	Very high	168 Å²	168	58 Å²	58	73%	0.73	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-28.5	169.1	-76.7	176.5	-178.8	-179.5	0	112.6	S135 D152	S135-K154 VanDerWaalsContact O-CG 3.3Å; S135-K154 WeakPolarHBondContact O-CG 3.49Å; S135-K154 PolarHBondContact O-N 3.49Å; S135-K154 VanDerWaalsContact O-N 3.13Å; D152-K154 PolarHBondContact O-N 2.98Å
155	N	94.8	Very high	93.8	Very high	121 Å²	121	58.4 Å²	58.4	65%	0.647	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.1	-26.4	-178	-56.5	-47.1	0	0	0	112.2	D152 G153	D152-N155 VanDerWaalsContact CG-ND2 3.26Å; D152-N155 PolarHBondContact O-N 2.79Å; D152-N155 PolarHBondContact OD1-ND2 2.88Å; D152-N155 WeakPolarHBondContact OD2-CB 3.48Å; D152-N155 PolarHBondContact OD2-ND2 2.87Å; G153-N155 VanDerWaalsContact C-N 3.32Å
156	L	95	Very high	93.4	Very high	93 Å²	93	62.6 Å²	62.6	49%	0.487	33%	0.328	S	S	.	.	S	Bend	trans	-117.1	141.7	-175.2	-59.8	-179.8	0	0	0	111.7	D152 G153	D152-L156 HydrophobicContact CB-CD1 4.13Å; D152-L156 HydrophobicContact CB-CG 4.4Å; D152-L156 PolarHBondContact O-N 3.03Å; G153-L156 CarbonylContact C-O 3.41Å; G153-L156 WeakPolarHBondContact CA-O 3.49Å
157	P	94.8	Very high	92.8	Very high	122 Å²	122	61 Å²	61	79%	0.792	33%	0.333	S	S	*	.	P	Polyproline II helix	trans	-69.6	149.2	174.2	30.4	-34.7	0	0	0	111.2
158	G	94	Very high	92.1	Very high	22 Å²	22	66 Å²	66	23%	0.227	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-66	140.8	173.1	0	0	0	0	0	112	L149 Y150	L149-G158 CarbonylContact O-C 3.55Å; L149-G158 VanDerWaalsContact O-CA 3.22Å; L149-G158 WeakPolarHBondContact O-CA 3.38Å; Y150-G158 VanDerWaalsContact CE1-CA 3.5Å
159	K	95.6	Very high	91.5	Very high	143 Å²	143	64.2 Å²	64.2	62%	0.622	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.3	131.5	179.1	-176.5	-178.2	177.1	-175.6	0	110.7	K148 L149 Y161	K148-K159 CarbonylContact C-O 3.54Å; K148-K159 WeakPolarHBondContact CA-O 3.3Å; L149-K159 HydrophobicContact CB-CB 4.44Å; L149-K159 PolarHBondContact N-O 3.38Å; L149-K159 PolarHBondContact O-N 2.85Å; K159-Y161 PolarHBondContact O-N 3.33Å
160	T	95.5	Very high	90.7	Very high	34 Å²	34	66 Å²	66	21%	0.209	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	136.6	175.9	-55.8	0	0	0	0	111.6	S147 L165	S147-T160 WeakPolarHBondContact O-CA 3.41Å; T160-L165 HydrophobicContact CG2-CB 3.64Å; T160-L165 HydrophobicContact CG2-CD1 4.11Å
161	Y	94.2	Very high	90.1	Very high	7 Å²	7	64.3 Å²	64.3	3%	0.027	36%	0.358	C	S	.	.	S	Bend	trans	-151.7	132.9	176.2	-178.7	-88	0	0	0	111.6	W142 S147 L149 K159 Y190 L197 G198 A200	W142-Y161 AromaticContact CD2-CD1 3.93Å; W142-Y161 HydrophobicContact CD2-CD1 3.93Å; W142-Y161 HydrophobicContact CD2-CE1 4.16Å; W142-Y161 AromaticContact CE2-CD1 3.5Å; W142-Y161 HydrophobicContact CE3-CD1 4.48Å; W142-Y161 HydrophobicContact CE3-CE1 4.25Å; W142-Y161 HydrophobicContact CG-CD1 4.34Å; W142-Y161 HydrophobicContact CH2-CD1 4.26Å; W142-Y161 HydrophobicContact CH2-CE1 4.06Å; W142-Y161 AromaticContact CZ2-CD1 3.68Å; W142-Y161 HydrophobicContact CZ2-CD1 3.68Å; W142-Y161 AromaticContact CZ2-CE1 3.96Å; W142-Y161 HydrophobicContact CZ2-CE1 3.96Å; W142-Y161 HydrophobicContact CZ3-CE1 4.2Å; W142-Y161 AromaticContact NE1-CD1 3.66Å; W142-Y161 PolarHBondContact NE1-O 3.22Å; S147-Y161 CarbonylContact C-O 3.58Å; S147-Y161 WeakPolarHBondContact CB-O 3.28Å; S147-Y161 PolarHBondContact O-N 2.93Å; S147-Y161 VanDerWaalsContact O-O 3.07Å; L149-Y161 HydrophobicContact CD1-CD2 3.74Å; L149-Y161 HydrophobicContact CD1-CG 3.88Å; L149-Y161 HydrophobicContact CD2-CD1 4.2Å; L149-Y161 HydrophobicContact CD2-CD2 4.43Å; L149-Y161 HydrophobicContact CD2-CG 3.93Å; L149-Y161 VanDerWaalsContact CG-CB 3.47Å; L149-Y161 HydrophobicContact CG-CD2 4.32Å; L149-Y161 HydrophobicContact CG-CG 3.94Å; K159-Y161 PolarHBondContact O-N 3.33Å; Y161-Y190 AromaticContact CE1-CD2 3.71Å; Y161-Y190 HydrophobicContact CE1-CD2 3.71Å; Y161-Y190 HydrophobicContact CE1-CG 4.39Å; Y161-Y190 AromaticContact CZ-CD2 3.84Å; Y161-Y190 PolarHBondContact OH-N 3.43Å; Y161-L197 HydrophobicContact CE1-CB 3.89Å; Y161-L197 HydrophobicContact CE1-CD1 4.08Å; Y161-L197 HydrophobicContact CE2-CB 4.48Å; Y161-L197 WeakPolarHBondContact CE2-O 3.42Å; Y161-L197 WeakPolarHBondContact OH-CB 3.48Å; Y161-G198 PolarHBondContact OH-O 2.9Å; Y161-A200 HydrophobicContact CD2-CB 4.22Å; Y161-A200 HydrophobicContact CE2-CB 3.84Å
162	P	92.1	Very high	89.7	Confident	0 Å²	0	63 Å²	63	0%	0	35%	0.353	C	S	.	.	S	Bend	cis	-67.8	160.3	7	-26.7	39.4	0	0	0	115.4	F164 L165 F171 L197	P162-F164 HydrophobicContact CB-CD1 3.61Å; P162-F164 HydrophobicContact CB-CD2 4.4Å; P162-F164 HydrophobicContact CB-CE1 3.22Å; P162-F164 HydrophobicContact CB-CE2 4.08Å; P162-F164 HydrophobicContact CB-CG 4.19Å; P162-F164 HydrophobicContact CB-CZ 3.48Å; P162-F164 VanDerWaalsContact CB-CZ 3.48Å; P162-F164 HydrophobicContact CG-CE1 3.75Å; P162-F164 HydrophobicContact CG-CE2 4.32Å; P162-F164 HydrophobicContact CG-CZ 3.6Å; P162-F164 PolarHBondContact O-N 2.87Å; P162-F164 VanDerWaalsContact O-N 3.17Å; P162-L165 WeakPolarHBondContact O-CB 3.32Å; P162-L165 WeakPolarHBondContact O-CG 3.31Å; P162-L165 PolarHBondContact O-N 2.81Å; P162-L165 VanDerWaalsContact O-N 3.09Å; P162-F171 HydrophobicContact CG-CD1 4.42Å; P162-F171 HydrophobicContact CG-CE1 4.46Å; P162-L197 HydrophobicContact CB-CB 4.41Å; P162-L197 HydrophobicContact CB-CD2 4.46Å; P162-L197 HydrophobicContact CG-CB 4.08Å; P162-L197 HydrophobicContact CG-CD1 3.84Å; P162-L197 HydrophobicContact CG-CD2 3.83Å; P162-L197 HydrophobicContact CG-CG 4.11Å
163	A	88.5	Confident	89.4	Confident	81 Å²	81	61.2 Å²	61.2	67%	0.669	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-14.4	-173.3	0	0	0	0	0	114.6	L165	A163-L165 VanDerWaalsContact C-N 3.32Å
164	F	84.3	Confident	89.4	Confident	28 Å²	28	60.7 Å²	60.7	12%	0.123	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-12	174.2	58.9	-110.7	0	0	0	113.5	L22 E25 L26 L29 P162 F171 L197	L22-F164 HydrophobicContact CD2-CD2 3.46Å; L22-F164 VanDerWaalsContact CD2-CD2 3.46Å; L22-F164 HydrophobicContact CD2-CE2 3.78Å; L22-F164 HydrophobicContact CD2-CG 4.19Å; E25-F164 HydrophobicContact CB-CB 4.19Å; E25-F164 WeakPolarHBondContact OE2-CB 3.12Å; L26-F164 HydrophobicContact CD2-CD1 4.45Å; L26-F164 HydrophobicContact CD2-CE1 3.57Å; L26-F164 HydrophobicContact CD2-CZ 3.94Å; L26-F164 HydrophobicContact CG-CE1 4.36Å; L29-F164 HydrophobicContact CD1-CD1 3.59Å; L29-F164 HydrophobicContact CD1-CE1 3.9Å; P162-F164 HydrophobicContact CB-CD1 3.61Å; P162-F164 HydrophobicContact CB-CD2 4.4Å; P162-F164 HydrophobicContact CB-CE1 3.22Å; P162-F164 HydrophobicContact CB-CE2 4.08Å; P162-F164 HydrophobicContact CB-CG 4.19Å; P162-F164 HydrophobicContact CB-CZ 3.48Å; P162-F164 VanDerWaalsContact CB-CZ 3.48Å; P162-F164 HydrophobicContact CG-CE1 3.75Å; P162-F164 HydrophobicContact CG-CE2 4.32Å; P162-F164 HydrophobicContact CG-CZ 3.6Å; P162-F164 PolarHBondContact O-N 2.87Å; P162-F164 VanDerWaalsContact O-N 3.17Å; F164-F171 HydrophobicContact CE2-CD2 4.26Å; F164-F171 HydrophobicContact CE2-CE2 4.28Å; F164-F171 HydrophobicContact CZ-CD2 4.26Å; F164-F171 AromaticContact CZ-CE2 3.9Å; F164-F171 HydrophobicContact CZ-CE2 3.9Å; F164-L197 HydrophobicContact CE1-CD2 4.2Å; F164-L197 HydrophobicContact CZ-CD2 4.48Å
165	L	85.8	Confident	89.6	Confident	12 Å²	12	56.3 Å²	56.3	6%	0.063	32%	0.319	C	S	.	.	S	Bend	trans	-72.7	138.6	176.9	-61.9	177.5	0	0	0	110	I12 T160 P162 A163 D169 F171	I12-L165 HydrophobicContact CD1-CD2 3.45Å; I12-L165 VanDerWaalsContact CD1-CD2 3.45Å; T160-L165 HydrophobicContact CG2-CB 3.64Å; T160-L165 HydrophobicContact CG2-CD1 4.11Å; P162-L165 WeakPolarHBondContact O-CB 3.32Å; P162-L165 WeakPolarHBondContact O-CG 3.31Å; P162-L165 PolarHBondContact O-N 2.81Å; P162-L165 VanDerWaalsContact O-N 3.09Å; A163-L165 VanDerWaalsContact C-N 3.32Å; L165-D169 HydrophobicContact CB-CB 4.42Å; L165-D169 HydrophobicContact CD2-CB 4.42Å; L165-F171 HydrophobicContact CD1-CB 3.76Å; L165-F171 HydrophobicContact CD2-CB 4.08Å; L165-F171 HydrophobicContact CD2-CD2 4.32Å; L165-F171 HydrophobicContact CG-CB 4.48Å
166	E	84.6	Confident	89.7	Confident	130 Å²	130	52.5 Å²	52.5	61%	0.607	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-66.2	155.8	164.5	-69.3	-65.8	159.5	0	0	110.3	D168 D169	E166-D168 PolarHBondContact O-N 2.78Å; E166-D169 PolarHBondContact O-N 2.82Å
167	P	80	Confident	89.9	Confident	89 Å²	89	48.2 Å²	48.2	58%	0.578	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	131.3	171.2	-23.7	34.2	0	0	0	110.9	D169	P167-D169 VanDerWaalsContact C-N 3.29Å; P167-D169 PolarHBondContact O-N 2.89Å
168	D	79.1	Confident	90.1	Very high	106 Å²	106	44 Å²	44	57%	0.567	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	75	-3	179.8	-50.5	-43.6	0	0	0	117	E166	E166-D168 PolarHBondContact O-N 2.78Å
169	D	84.7	Confident	90.3	Very high	19 Å²	19	42.9 Å²	42.9	10%	0.102	24%	0.239	C	C	.	.			trans	-67.3	142.9	167.3	-80.7	-6.8	0	0	0	111	K10 I12 L165 E166 P167	K10-D169 WeakPolarHBondContact CB-OD1 3.34Å; K10-D169 PolarHBondContact N-OD1 2.91Å; K10-D169 WeakPolarHBondContact O-CA 3.39Å; I12-D169 HydrophobicContact CD1-CB 4.31Å; L165-D169 HydrophobicContact CB-CB 4.42Å; L165-D169 HydrophobicContact CD2-CB 4.42Å; E166-D169 PolarHBondContact O-N 2.82Å; P167-D169 VanDerWaalsContact C-N 3.29Å; P167-D169 PolarHBondContact O-N 2.89Å
170	T	80.7	Confident	90.4	Very high	46 Å²	46	36.3 Å²	36.3	28%	0.282	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	125.9	179.5	-54.5	0	0	0	0	110.1	K10 T11 I12	K10-T170 PolarHBondContact O-N 3.01Å; T11-T170 CarbonylContact C-O 3.47Å; T11-T170 WeakPolarHBondContact CA-O 3.36Å; I12-T170 PolarHBondContact N-O 2.96Å
171	F	86.9	Confident	90.6	Very high	2 Å²	2	34.7 Å²	34.7	1%	0.009	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	118.1	175.3	-176.5	-105.6	0	0	0	110.3	I12 M14 W142 S147 P162 F164 L165 I173 V192 L197	I12-F171 HydrophobicContact CB-CD2 4.39Å; I12-F171 HydrophobicContact CG2-CD2 3.9Å; I12-F171 HydrophobicContact CG2-CE2 4.32Å; M14-F171 HydrophobicContact CE-CZ 3.79Å; M14-F171 HydrophobicContact CG-CE2 3.51Å; M14-F171 HydrophobicContact CG-CZ 3.65Å; M14-F171 HydrophobicContact SD-CE2 3.94Å; M14-F171 HydrophobicContact SD-CZ 3.6Å; M14-F171 VanDerWaalsContact SD-CZ 3.6Å; W142-F171 HydrophobicContact CH2-CD1 4.48Å; W142-F171 HydrophobicContact CZ2-CD1 4.37Å; S147-F171 WeakPolarHBondContact OG-CB 3.18Å; S147-F171 PolarHBondContact OG-N 3.17Å; P162-F171 HydrophobicContact CG-CD1 4.42Å; P162-F171 HydrophobicContact CG-CE1 4.46Å; F164-F171 HydrophobicContact CE2-CD2 4.26Å; F164-F171 HydrophobicContact CE2-CE2 4.28Å; F164-F171 HydrophobicContact CZ-CD2 4.26Å; F164-F171 AromaticContact CZ-CE2 3.9Å; F164-F171 HydrophobicContact CZ-CE2 3.9Å; L165-F171 HydrophobicContact CD1-CB 3.76Å; L165-F171 HydrophobicContact CD2-CB 4.08Å; L165-F171 HydrophobicContact CD2-CD2 4.32Å; L165-F171 HydrophobicContact CG-CB 4.48Å; F171-I173 HydrophobicContact CD1-CD1 4.49Å; F171-I173 HydrophobicContact CD1-CG1 3.66Å; F171-I173 HydrophobicContact CE1-CG1 4.11Å; F171-I173 PolarHBondContact O-N 2.77Å; F171-V192 HydrophobicContact CE1-CB 4.34Å; F171-V192 HydrophobicContact CE1-CG1 4.19Å; F171-V192 HydrophobicContact CE1-CG2 4.42Å; F171-V192 HydrophobicContact CZ-CG1 4.5Å; F171-L197 HydrophobicContact CE1-CD1 4.19Å; F171-L197 HydrophobicContact CZ-CD2 4.38Å
172	I	88.4	Confident	90.8	Very high	35 Å²	35	34.8 Å²	34.8	18%	0.179	20%	0.202	C	C	.	.			trans	-71.2	113.2	176.5	-68.9	173.4	0	0	0	108.4	T11 I12 D13 M106	T11-I172 HydrophobicContact CG2-CD1 3.37Å; T11-I172 HydrophobicContact CG2-CG1 3.56Å; I12-I172 PolarHBondContact O-N 2.84Å; D13-I172 HydrophobicContact CB-CB 4.27Å; D13-I172 HydrophobicContact CB-CD1 4.01Å; M106-I172 HydrophobicContact CE-CG1 4.36Å; M106-I172 HydrophobicContact CE-CG2 3.92Å; M106-I172 HydrophobicContact SD-CG2 4.24Å
173	I	92.1	Very high	91	Very high	1 Å²	1	35 Å²	35	1%	0.005	20%	0.203	C	C	.	.			trans	-95.2	123.9	175.9	-59.7	157.3	0	0	0	107.5	R109 W142 L144 F171 L177 V192	R109-I173 PolarHBondContact NH1-O 2.87Å; R109-I173 PolarHBondContact NH2-O 2.91Å; W142-I173 HydrophobicContact CD2-CD1 4.45Å; W142-I173 HydrophobicContact CH2-CD1 3.47Å; W142-I173 VanDerWaalsContact CH2-CD1 3.47Å; W142-I173 HydrophobicContact CH2-CG1 3.79Å; W142-I173 HydrophobicContact CZ2-CD1 3.32Å; W142-I173 HydrophobicContact CZ2-CG1 3.97Å; W142-I173 HydrophobicContact CZ3-CD1 4.09Å; L144-I173 HydrophobicContact CB-CD1 3.74Å; L144-I173 HydrophobicContact CD2-CD1 3.66Å; L144-I173 HydrophobicContact CD2-CG2 4.5Å; L144-I173 HydrophobicContact CG-CD1 4.26Å; L144-I173 WeakPolarHBondContact O-CD1 3.36Å; F171-I173 HydrophobicContact CD1-CD1 4.49Å; F171-I173 HydrophobicContact CD1-CG1 3.66Å; F171-I173 HydrophobicContact CE1-CG1 4.11Å; F171-I173 PolarHBondContact O-N 2.77Å; I173-L177 HydrophobicContact CG2-CB 4.46Å; I173-L177 HydrophobicContact CG2-CD2 4.1Å; I173-V192 HydrophobicContact CG2-CG2 4.33Å
174	P	94.4	Very high	91.3	Very high	16 Å²	16	32.7 Å²	32.7	10%	0.104	18%	0.179	C	C	.	.			trans	-64.9	175.7	176.3	31.9	-37.4	0	0	0	111	R109 S176 V192	R109-P174 PolarHBondContact NH2-O 3.36Å; P174-S176 PolarHBondContact O-N 2.9Å; P174-V192 HydrophobicContact CG-CG1 3.65Å
175	D	96.6	Very high	91.8	Very high	75 Å²	75	37.9 Å²	37.9	40%	0.401	20%	0.204	S	C	.	.	S	Bend	trans	-59.5	-31.6	-176.3	-72.6	-4.4	0	0	0	113.2	N103 W104 A105 M106	N103-D175 CarbonylContact C-O 3.55Å; N103-D175 WeakPolarHBondContact CA-O 3.34Å; W104-D175 CarbonylContact C-O 3.51Å; W104-D175 PolarHBondContact N-O 3.19Å; A105-D175 WeakPolarHBondContact CA-OD1 3.41Å; M106-D175 PolarHBondContact N-OD1 2.88Å
176	S	97.4	Very high	92.4	Very high	42 Å²	42	37.3 Å²	37.3	29%	0.294	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	136.1	178.9	-67.2	0	0	0	0	112.2	I102 N103 P174	I102-S176 WeakPolarHBondContact O-CA 3.47Å; N103-S176 PolarHBondContact ND2-OG 3.49Å; P174-S176 PolarHBondContact O-N 2.9Å
177	L	98	Very high	93	Very high	3 Å²	3	31.7 Å²	31.7	2%	0.016	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	156.3	166.3	66.8	134.4	0	0	0	110.4	E101 I102 V115 W142 L144 I173 V179 Y190 V192	E101-L177 WeakPolarHBondContact CA-O 3.36Å; I102-L177 HydrophobicContact CB-CD2 4.41Å; I102-L177 HydrophobicContact CB-CG 4.44Å; I102-L177 PolarHBondContact N-O 2.83Å; I102-L177 PolarHBondContact O-N 2.85Å; V115-L177 HydrophobicContact CG1-CD1 4.46Å; W142-L177 HydrophobicContact CE3-CD1 4.27Å; W142-L177 HydrophobicContact CZ3-CD1 4.12Å; L144-L177 HydrophobicContact CD1-CD2 4.02Å; L144-L177 HydrophobicContact CD2-CD1 4.47Å; L144-L177 HydrophobicContact CD2-CD2 4.25Å; I173-L177 HydrophobicContact CG2-CB 4.46Å; I173-L177 HydrophobicContact CG2-CD2 4.1Å; L177-V179 HydrophobicContact CD1-CG2 4.29Å; L177-Y190 HydrophobicContact CD1-CD1 3.68Å; L177-Y190 HydrophobicContact CD1-CE1 4.3Å; L177-V192 HydrophobicContact CB-CG2 4.04Å
178	L	98.6	Very high	93.9	Very high	32 Å²	32	27.4 Å²	27.4	17%	0.168	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	140.7	168.7	-48.1	176.7	0	0	0	110.1	L41 V99 W100 E101 Y190 I191 I227	L41-L178 HydrophobicContact CD2-CD1 3.92Å; V99-L178 HydrophobicContact CG1-CB 4.07Å; V99-L178 HydrophobicContact CG1-CD1 4.32Å; W100-L178 WeakPolarHBondContact O-CA 3.42Å; E101-L178 HydrophobicContact CB-CD2 3.56Å; E101-L178 HydrophobicContact CG-CD2 4.01Å; L178-Y190 CarbonylContact O-C 3.57Å; L178-Y190 VanDerWaalsContact O-CA 3.3Å; L178-Y190 WeakPolarHBondContact O-CA 3.3Å; L178-I191 HydrophobicContact CB-CB 4.01Å; L178-I191 HydrophobicContact CB-CD1 4.43Å; L178-I191 HydrophobicContact CD1-CB 4.29Å; L178-I191 HydrophobicContact CD1-CD1 4.03Å; L178-I191 HydrophobicContact CD1-CG2 4.46Å; L178-I191 HydrophobicContact CG-CB 4.38Å; L178-I191 PolarHBondContact N-O 3.07Å; L178-I191 PolarHBondContact O-N 3.26Å; L178-I227 HydrophobicContact CD2-CD1 4.43Å; L178-I227 HydrophobicContact CD2-CG1 4.13Å
179	V	98.8	Very high	94.8	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	131.6	171	-171.8	0	0	0	0	107.6	V99 W100 I102 V115 L177 L188 Y190	V99-V179 WeakPolarHBondContact CA-O 3.29Å; W100-V179 HydrophobicContact CD2-CB 4.11Å; W100-V179 HydrophobicContact CG-CB 4.4Å; W100-V179 HydrophobicContact CH2-CG1 4.06Å; W100-V179 HydrophobicContact CZ2-CB 3.85Å; W100-V179 HydrophobicContact CZ2-CG1 3.42Å; W100-V179 VanDerWaalsContact CZ2-CG1 3.42Å; W100-V179 PolarHBondContact N-O 2.97Å; W100-V179 PolarHBondContact O-N 3.29Å; I102-V179 HydrophobicContact CG1-CG2 4.06Å; V115-V179 HydrophobicContact CG1-CG2 3.67Å; L177-V179 HydrophobicContact CD1-CG2 4.29Å; V179-L188 HydrophobicContact CG1-CD1 3.57Å; V179-Y190 HydrophobicContact CB-CD1 4.45Å; V179-Y190 HydrophobicContact CG1-CD1 4.33Å; V179-Y190 HydrophobicContact CG1-CE1 4.03Å; V179-Y190 HydrophobicContact CG2-CD1 4.09Å; V179-Y190 HydrophobicContact CG2-CE1 4.04Å
180	V	98.6	Very high	95.4	Very high	5 Å²	5	21.5 Å²	21.5	3%	0.03	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	109.8	-177.5	-176.5	0	0	0	0	108.6	L37 L97 V99 L188 G189 I191	L37-V180 HydrophobicContact CD1-CB 4.49Å; L37-V180 HydrophobicContact CD1-CG1 3.72Å; L37-V180 HydrophobicContact CD1-CG2 3.91Å; L37-V180 HydrophobicContact CD2-CG1 4Å; L37-V180 HydrophobicContact CD2-CG2 4.1Å; L37-V180 HydrophobicContact CG-CG1 4.43Å; L97-V180 HydrophobicContact CD1-CG1 3.72Å; V99-V180 HydrophobicContact CG2-CG1 4.24Å; V99-V180 HydrophobicContact CG2-CG2 4.19Å; V180-L188 CarbonylContact O-C 3.45Å; V180-L188 WeakPolarHBondContact O-CA 3.33Å; V180-G189 PolarHBondContact N-O 3.46Å; V180-G189 PolarHBondContact O-N 3.42Å; V180-I191 HydrophobicContact CG2-CD1 3.85Å; V180-I191 HydrophobicContact CG2-CG1 3.96Å
181	L	98.7	Very high	96.1	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	115	176.3	177.4	68.1	0	0	0	109.5	Y93 L97 H98 W100 V117 M183 L188 L204 L209	Y93-L181 HydrophobicContact CD2-CD2 3.77Å; Y93-L181 HydrophobicContact CG-CD2 4.3Å; L97-L181 CarbonylContact C-O 3.39Å; L97-L181 WeakPolarHBondContact CA-O 3.26Å; H98-L181 PolarHBondContact N-O 2.83Å; H98-L181 PolarHBondContact O-N 3.45Å; W100-L181 HydrophobicContact CH2-CB 3.67Å; W100-L181 HydrophobicContact CH2-CD2 3.99Å; W100-L181 HydrophobicContact CH2-CG 4.45Å; W100-L181 HydrophobicContact CZ3-CB 3.71Å; W100-L181 HydrophobicContact CZ3-CD2 4.2Å; V117-L181 HydrophobicContact CG1-CD1 4.32Å; V117-L181 HydrophobicContact CG1-CD2 4.27Å; L181-M183 HydrophobicContact CD1-SD 3.75Å; L181-M183 HydrophobicContact CD2-CG 4.01Å; L181-M183 HydrophobicContact CD2-SD 3.77Å; L181-M183 HydrophobicContact CG-CG 4.02Å; L181-M183 HydrophobicContact CG-SD 3.82Å; L181-L188 HydrophobicContact CB-CD1 4.2Å; L181-L188 HydrophobicContact CD1-CD1 4.2Å; L181-L204 HydrophobicContact CD1-CD1 3.88Å; L181-L209 HydrophobicContact CD1-CD1 4.28Å; L181-L209 HydrophobicContact CD2-CB 4.3Å
182	D	97.8	Very high	96.5	Very high	9 Å²	9	19.6 Å²	19.6	5%	0.048	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	103.8	172.1	-166.1	-42.8	0	0	0	108.6	L97 D184 E185 G186 T187	L97-D182 HydrophobicContact CD1-CB 3.75Å; D182-D184 VanDerWaalsContact C-N 3.32Å; D182-D184 WeakPolarHBondContact OD1-CB 3.2Å; D182-D184 PolarHBondContact OD1-N 3.28Å; D182-E185 HydrophobicContact CB-CB 4.31Å; D182-E185 PolarHBondContact OD1-N 3.43Å; D182-G186 CarbonylContact O-C 3.43Å; D182-G186 WeakPolarHBondContact O-CA 3.49Å; D182-G186 PolarHBondContact O-N 3.04Å; D182-T187 PolarHBondContact N-O 3.1Å; D182-T187 PolarHBondContact O-N 2.95Å
183	M	97.8	Very high	96.5	Very high	3 Å²	3	21.4 Å²	21.4	2%	0.015	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-16.2	179.8	-69.2	-57.6	-62.6	0	0	112.9	R95 G96 L181 L204 K207 L209	R95-M183 VanDerWaalsContact CA-CB 3.49Å; G96-M183 WeakPolarHBondContact O-CB 3.48Å; G96-M183 PolarHBondContact O-N 3.19Å; L181-M183 HydrophobicContact CD1-SD 3.75Å; L181-M183 HydrophobicContact CD2-CG 4.01Å; L181-M183 HydrophobicContact CD2-SD 3.77Å; L181-M183 HydrophobicContact CG-CG 4.02Å; L181-M183 HydrophobicContact CG-SD 3.82Å; M183-L204 WeakPolarHBondContact CE-O 3.26Å; M183-K207 WeakPolarHBondContact CE-O 3.3Å; M183-L209 HydrophobicContact CE-CD1 4.23Å; M183-L209 HydrophobicContact CE-CG 4.29Å; M183-L209 HydrophobicContact SD-CB 4.29Å; M183-L209 HydrophobicContact SD-CD1 3.9Å; M183-L209 HydrophobicContact SD-CG 4.31Å
184	D	94	Very high	96.3	Very high	33 Å²	33	24.3 Å²	24.3	18%	0.176	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-45.3	179.9	-59.7	-32.3	0	0	0	110.6	R36 G96 D182 K205 P232	R36-D184 IonicContact NH2-OD2 3.68Å; G96-D184 VanDerWaalsContact CA-OD2 3.24Å; G96-D184 WeakPolarHBondContact CA-OD2 3.49Å; G96-D184 VanDerWaalsContact N-CG 3.34Å; G96-D184 PolarHBondContact N-OD1 3.09Å; G96-D184 PolarHBondContact N-OD2 3.26Å; D182-D184 VanDerWaalsContact C-N 3.32Å; D182-D184 WeakPolarHBondContact OD1-CB 3.2Å; D182-D184 PolarHBondContact OD1-N 3.28Å; D184-K205 WeakPolarHBondContact O-CE 3.41Å; D184-K205 PolarHBondContact O-NZ 2.81Å; D184-P232 VanDerWaalsContact OD1-CG 3.31Å; D184-P232 WeakPolarHBondContact OD1-CG 3.43Å; D184-P232 VanDerWaalsContact OD2-CA 3.31Å; D184-P232 WeakPolarHBondContact OD2-CA 3.43Å; D184-P232 WeakPolarHBondContact OD2-CB 3.38Å
185	E	94.9	Very high	96	Very high	137 Å²	137	27.1 Å²	27.1	64%	0.64	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-18.1	171.3	-66.7	-60.4	141.4	0	0	112.4	D182 T187	D182-E185 HydrophobicContact CB-CB 4.31Å; D182-E185 PolarHBondContact OD1-N 3.43Å; E185-T187 HydrophobicContact CB-CG2 4.08Å
186	G	97.5	Very high	95.8	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	47.4	-177.8	0	0	0	0	0	112.7	D182 R202 G203 L204	D182-G186 CarbonylContact O-C 3.43Å; D182-G186 WeakPolarHBondContact O-CA 3.49Å; D182-G186 PolarHBondContact O-N 3.04Å; G186-R202 CarbonylContact O-C 3.53Å; G186-R202 WeakPolarHBondContact O-CA 3.41Å; G186-G203 PolarHBondContact O-N 2.92Å; G186-L204 WeakPolarHBondContact O-CB 3.44Å; G186-L204 PolarHBondContact O-N 2.94Å
187	T	98.3	Very high	95.6	Very high	12 Å²	12	22 Å²	22	7%	0.074	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	151.7	-177.8	70.4	0	0	0	0	113.3	D182 E185 V199 F201 R202	D182-T187 PolarHBondContact N-O 3.1Å; D182-T187 PolarHBondContact O-N 2.95Å; E185-T187 HydrophobicContact CB-CG2 4.08Å; T187-V199 HydrophobicContact CG2-CG1 4.12Å; T187-F201 VanDerWaalsContact CA-O 3.24Å; T187-F201 WeakPolarHBondContact CA-O 3.49Å; T187-R202 HydrophobicContact CG2-CG 4.19Å
188	L	98.7	Very high	95.4	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	137.8	170.3	-176.9	68.8	0	0	0	108.7	V117 W140 V179 V180 L181 A200 F201 L204	V117-L188 HydrophobicContact CG1-CD1 3.93Å; V117-L188 HydrophobicContact CG1-CD2 4.34Å; V117-L188 HydrophobicContact CG2-CD2 3.96Å; W140-L188 HydrophobicContact CB-CD2 4.44Å; V179-L188 HydrophobicContact CG1-CD1 3.57Å; V180-L188 CarbonylContact O-C 3.45Å; V180-L188 WeakPolarHBondContact O-CA 3.33Å; L181-L188 HydrophobicContact CB-CD1 4.2Å; L181-L188 HydrophobicContact CD1-CD1 4.2Å; L188-A200 WeakPolarHBondContact O-CA 3.22Å; L188-A200 WeakPolarHBondContact O-CB 3.33Å; L188-A200 PolarHBondContact O-N 2.69Å; L188-F201 HydrophobicContact CB-CB 4.24Å; L188-F201 HydrophobicContact CB-CD2 4.16Å; L188-F201 HydrophobicContact CD2-CD2 3.77Å; L188-F201 HydrophobicContact CD2-CE2 4.16Å; L188-F201 HydrophobicContact CG-CD2 4.34Å; L188-F201 PolarHBondContact N-O 2.99Å; L188-F201 PolarHBondContact O-N 3.07Å; L188-F201 VanDerWaalsContact O-N 3.08Å; L188-L204 HydrophobicContact CB-CD1 3.71Å
189	G	97.9	Very high	95.3	Very high	1 Å²	1	23 Å²	23	1%	0.01	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	178.7	174.5	0	0	0	0	0	111.8	V180 G198	V180-G189 PolarHBondContact N-O 3.46Å; V180-G189 PolarHBondContact O-N 3.42Å; G189-G198 WeakPolarHBondContact CA-O 3.37Å
190	Y	97.8	Very high	95.2	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	149.6	-174	-55.8	-88.9	0	0	0	111.7	V115 W142 L149 Y161 L177 L178 V179 L197 A200	V115-Y190 HydrophobicContact CG1-CE1 4.38Å; V115-Y190 PolarHBondContact O-OH 3.23Å; W142-Y190 HydrophobicContact CB-CD2 4.49Å; W142-Y190 HydrophobicContact CB-CE1 4.22Å; W142-Y190 HydrophobicContact CB-CE2 3.71Å; W142-Y190 WeakPolarHBondContact CB-OH 3.25Å; W142-Y190 HydrophobicContact CD2-CD2 4.26Å; W142-Y190 HydrophobicContact CD2-CE2 4.33Å; W142-Y190 HydrophobicContact CD2-CG 4.47Å; W142-Y190 AromaticContact CE3-CD1 3.67Å; W142-Y190 HydrophobicContact CE3-CD1 3.67Å; W142-Y190 AromaticContact CE3-CD2 3.69Å; W142-Y190 HydrophobicContact CE3-CD2 3.69Å; W142-Y190 AromaticContact CE3-CE1 3.98Å; W142-Y190 HydrophobicContact CE3-CE1 3.98Å; W142-Y190 HydrophobicContact CE3-CE2 4.04Å; W142-Y190 AromaticContact CE3-CG 3.49Å; W142-Y190 HydrophobicContact CE3-CG 3.49Å; W142-Y190 VanDerWaalsContact CE3-CG 3.49Å; W142-Y190 HydrophobicContact CG-CE2 4.26Å; W142-Y190 HydrophobicContact CZ3-CD1 4.14Å; W142-Y190 HydrophobicContact CZ3-CD2 4.26Å; W142-Y190 AromaticContact CZ3-CG 3.78Å; W142-Y190 HydrophobicContact CZ3-CG 3.78Å; W142-Y190 PolarHBondContact N-OH 3.08Å; L149-Y190 HydrophobicContact CD2-CE2 4.28Å; Y161-Y190 AromaticContact CE1-CD2 3.71Å; Y161-Y190 HydrophobicContact CE1-CD2 3.71Å; Y161-Y190 HydrophobicContact CE1-CG 4.39Å; Y161-Y190 AromaticContact CZ-CD2 3.84Å; Y161-Y190 PolarHBondContact OH-N 3.43Å; L177-Y190 HydrophobicContact CD1-CD1 3.68Å; L177-Y190 HydrophobicContact CD1-CE1 4.3Å; L178-Y190 CarbonylContact O-C 3.57Å; L178-Y190 VanDerWaalsContact O-CA 3.3Å; L178-Y190 WeakPolarHBondContact O-CA 3.3Å; V179-Y190 HydrophobicContact CB-CD1 4.45Å; V179-Y190 HydrophobicContact CG1-CD1 4.33Å; V179-Y190 HydrophobicContact CG1-CE1 4.03Å; V179-Y190 HydrophobicContact CG2-CD1 4.09Å; V179-Y190 HydrophobicContact CG2-CE1 4.04Å; Y190-L197 PolarHBondContact O-N 3.36Å; Y190-A200 HydrophobicContact CD2-CB 3.96Å; Y190-A200 HydrophobicContact CE2-CB 3.64Å
191	I	95.8	Very high	95.2	Very high	6 Å²	6	24.3 Å²	24.3	3%	0.031	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	129.4	171.1	-54	169.7	0	0	0	108.3	L37 L41 L178 V180 G194 H195 Y196	L37-I191 HydrophobicContact CD1-CD1 4.41Å; L37-I191 HydrophobicContact CD2-CD1 4.19Å; L41-I191 HydrophobicContact CD1-CD1 3.63Å; L178-I191 HydrophobicContact CB-CB 4.01Å; L178-I191 HydrophobicContact CB-CD1 4.43Å; L178-I191 HydrophobicContact CD1-CB 4.29Å; L178-I191 HydrophobicContact CD1-CD1 4.03Å; L178-I191 HydrophobicContact CD1-CG2 4.46Å; L178-I191 HydrophobicContact CG-CB 4.38Å; L178-I191 PolarHBondContact N-O 3.07Å; L178-I191 PolarHBondContact O-N 3.26Å; V180-I191 HydrophobicContact CG2-CD1 3.85Å; V180-I191 HydrophobicContact CG2-CG1 3.96Å; I191-G194 VanDerWaalsContact CG2-C 3.46Å; I191-H195 VanDerWaalsContact CA-O 3.24Å; I191-H195 WeakPolarHBondContact CA-O 3.3Å; I191-H195 WeakPolarHBondContact CG2-O 3.35Å; I191-Y196 HydrophobicContact CG1-CD2 3.93Å
192	V	93.6	Very high	95.2	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.006	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	134	175.5	179.2	0	0	0	0	108.3	M14 W142 F171 I173 P174 L177 G194 H195 L197	M14-V192 HydrophobicContact CE-CB 3.98Å; M14-V192 HydrophobicContact CE-CG1 3.61Å; M14-V192 WeakPolarHBondContact CE-O 3.35Å; W142-V192 HydrophobicContact CH2-CG2 4.02Å; W142-V192 HydrophobicContact CZ3-CG2 4.14Å; F171-V192 HydrophobicContact CE1-CB 4.34Å; F171-V192 HydrophobicContact CE1-CG1 4.19Å; F171-V192 HydrophobicContact CE1-CG2 4.42Å; F171-V192 HydrophobicContact CZ-CG1 4.5Å; I173-V192 HydrophobicContact CG2-CG2 4.33Å; P174-V192 HydrophobicContact CG-CG1 3.65Å; L177-V192 HydrophobicContact CB-CG2 4.04Å; V192-G194 PolarHBondContact O-N 3.16Å; V192-H195 PolarHBondContact N-O 3.49Å; V192-H195 WeakPolarHBondContact O-CB 3.42Å; V192-H195 PolarHBondContact O-N 3.19Å; V192-L197 HydrophobicContact CB-CD1 3.94Å; V192-L197 HydrophobicContact CG2-CD1 3.54Å
193	D	89.2	Confident	95.2	Very high	73 Å²	73	34.8 Å²	34.8	39%	0.39	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	41.5	43.2	-173.9	-58.9	-42.2	0	0	0	113.8	M14 H195	M14-D193 HydrophobicContact CE-CB 3.67Å; M14-D193 WeakPolarHBondContact CE-OD2 3.44Å; D193-H195 VanDerWaalsContact C-N 3.27Å; D193-H195 PolarHBondContact O-N 2.84Å; D193-H195 PolarHBondContact O-ND1 2.86Å
194	G	87.1	Confident	95.2	Very high	62 Å²	62	34.7 Å²	34.7	64%	0.639	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.6	-6.9	179.9	0	0	0	0	0	116.2	I191 V192	I191-G194 VanDerWaalsContact CG2-C 3.46Å; V192-G194 PolarHBondContact O-N 3.16Å
195	H	89.2	Confident	95.3	Very high	75 Å²	75	40.1 Å²	40.1	35%	0.347	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	122.8	-179.7	-61.7	85	0	0	0	111.3	M14 L26 I191 V192 D193 L197	M14-H195 HydrophobicContact SD-CB 4.46Å; L26-H195 HydrophobicContact CD2-CB 4.23Å; I191-H195 VanDerWaalsContact CA-O 3.24Å; I191-H195 WeakPolarHBondContact CA-O 3.3Å; I191-H195 WeakPolarHBondContact CG2-O 3.35Å; V192-H195 PolarHBondContact N-O 3.49Å; V192-H195 WeakPolarHBondContact O-CB 3.42Å; V192-H195 PolarHBondContact O-N 3.19Å; D193-H195 VanDerWaalsContact C-N 3.27Å; D193-H195 PolarHBondContact O-N 2.84Å; D193-H195 PolarHBondContact O-ND1 2.86Å; H195-L197 PolarHBondContact O-N 3.08Å
196	Y	92.8	Very high	95.3	Very high	8 Å²	8	37.2 Å²	37.2	3%	0.031	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	121.4	172.1	-179.8	-118.9	0	0	0	109.5	L29 K33 L37 I191 G198	L29-Y196 WeakPolarHBondContact CB-O 3.39Å; K33-Y196 HydrophobicContact CB-CD1 4.03Å; K33-Y196 HydrophobicContact CB-CG 4.41Å; K33-Y196 HydrophobicContact CG-CD1 4.16Å; K33-Y196 HydrophobicContact CG-CG 4.13Å; L37-Y196 HydrophobicContact CD2-CD2 3.97Å; L37-Y196 HydrophobicContact CD2-CE2 4.13Å; L37-Y196 HydrophobicContact CD2-CG 4.42Å; I191-Y196 HydrophobicContact CG1-CD2 3.93Å; Y196-G198 VanDerWaalsContact C-N 3.27Å; Y196-G198 PolarHBondContact O-N 3.42Å; Y196-G198 PolarHBondContact OH-O 3.39Å
197	L	93.4	Very high	95.4	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	7.4	-172	-60.1	175.6	0	0	0	113	L26 W142 Y161 P162 F164 F171 Y190 V192 H195	L26-L197 HydrophobicContact CD2-CD2 4.14Å; W142-L197 HydrophobicContact CH2-CD1 3.69Å; W142-L197 HydrophobicContact CZ3-CD1 4.24Å; Y161-L197 HydrophobicContact CE1-CB 3.89Å; Y161-L197 HydrophobicContact CE1-CD1 4.08Å; Y161-L197 HydrophobicContact CE2-CB 4.48Å; Y161-L197 WeakPolarHBondContact CE2-O 3.42Å; Y161-L197 WeakPolarHBondContact OH-CB 3.48Å; P162-L197 HydrophobicContact CB-CB 4.41Å; P162-L197 HydrophobicContact CB-CD2 4.46Å; P162-L197 HydrophobicContact CG-CB 4.08Å; P162-L197 HydrophobicContact CG-CD1 3.84Å; P162-L197 HydrophobicContact CG-CD2 3.83Å; P162-L197 HydrophobicContact CG-CG 4.11Å; F164-L197 HydrophobicContact CE1-CD2 4.2Å; F164-L197 HydrophobicContact CZ-CD2 4.48Å; F171-L197 HydrophobicContact CE1-CD1 4.19Å; F171-L197 HydrophobicContact CZ-CD2 4.38Å; Y190-L197 PolarHBondContact O-N 3.36Å; V192-L197 HydrophobicContact CB-CD1 3.94Å; V192-L197 HydrophobicContact CG2-CD1 3.54Å; H195-L197 PolarHBondContact O-N 3.08Å
198	G	93.3	Very high	95.4	Very high	6 Å²	6	45.4 Å²	45.4	6%	0.062	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	90.7	-174	-179.1	0	0	0	0	0	114	Y161 G189 Y196 A200	Y161-G198 PolarHBondContact OH-O 2.9Å; G189-G198 WeakPolarHBondContact CA-O 3.37Å; Y196-G198 VanDerWaalsContact C-N 3.27Å; Y196-G198 PolarHBondContact O-N 3.42Å; Y196-G198 PolarHBondContact OH-O 3.39Å; G198-A200 PolarHBondContact O-N 3.27Å
199	V	96.3	Very high	95.4	Very high	50 Å²	50	45.4 Å²	45.4	30%	0.303	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	118.1	178.7	176.8	0	0	0	0	109.7	T187 F201 R202	T187-V199 HydrophobicContact CG2-CG1 4.12Å; V199-F201 WeakPolarHBondContact CG1-O 3.36Å; V199-R202 HydrophobicContact CG1-CG 3.69Å
200	A	97.5	Very high	95.4	Very high	11 Å²	11	46.9 Å²	46.9	9%	0.091	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	-47.5	174.6	0	0	0	0	0	111.7	L149 Y161 L188 Y190 G198	L149-A200 HydrophobicContact CD1-CB 3.64Å; L149-A200 WeakPolarHBondContact CD1-O 3.24Å; L149-A200 HydrophobicContact CD2-CB 3.79Å; L149-A200 HydrophobicContact CG-CB 4.37Å; Y161-A200 HydrophobicContact CD2-CB 4.22Å; Y161-A200 HydrophobicContact CE2-CB 3.84Å; L188-A200 WeakPolarHBondContact O-CA 3.22Å; L188-A200 WeakPolarHBondContact O-CB 3.33Å; L188-A200 PolarHBondContact O-N 2.69Å; Y190-A200 HydrophobicContact CD2-CB 3.96Å; Y190-A200 HydrophobicContact CE2-CB 3.64Å; G198-A200 PolarHBondContact O-N 3.27Å
201	F	98.4	Very high	95.5	Very high	22 Å²	22	46.9 Å²	46.9	10%	0.096	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	153	-178.6	-55.8	-86.6	0	0	0	112.1	W140 G141 L149 Y150 H151 T187 L188 V199	W140-F201 HydrophobicContact CB-CD1 4.16Å; W140-F201 HydrophobicContact CB-CD2 3.96Å; W140-F201 HydrophobicContact CB-CE1 4.2Å; W140-F201 HydrophobicContact CB-CE2 3.98Å; W140-F201 HydrophobicContact CB-CG 4Å; W140-F201 HydrophobicContact CB-CZ 4.09Å; W140-F201 AromaticContact CD1-CD1 3.55Å; W140-F201 AromaticContact CD1-CG 3.82Å; W140-F201 HydrophobicContact CG-CD1 4.25Å; W140-F201 HydrophobicContact CG-CG 4.25Å; G141-F201 WeakPolarHBondContact O-CZ 3.47Å; L149-F201 HydrophobicContact CB-CE1 3.93Å; L149-F201 HydrophobicContact CB-CE2 4.29Å; L149-F201 HydrophobicContact CB-CZ 3.58Å; L149-F201 HydrophobicContact CD1-CZ 4.48Å; L149-F201 HydrophobicContact CD2-CE2 3.79Å; L149-F201 HydrophobicContact CD2-CZ 3.94Å; L149-F201 HydrophobicContact CG-CE2 4.41Å; L149-F201 HydrophobicContact CG-CZ 4.18Å; Y150-F201 WeakPolarHBondContact O-CZ 3.4Å; H151-F201 HydrophobicContact CB-CD1 4.26Å; H151-F201 HydrophobicContact CB-CE1 3.85Å; T187-F201 VanDerWaalsContact CA-O 3.24Å; T187-F201 WeakPolarHBondContact CA-O 3.49Å; L188-F201 HydrophobicContact CB-CB 4.24Å; L188-F201 HydrophobicContact CB-CD2 4.16Å; L188-F201 HydrophobicContact CD2-CD2 3.77Å; L188-F201 HydrophobicContact CD2-CE2 4.16Å; L188-F201 HydrophobicContact CG-CD2 4.34Å; L188-F201 PolarHBondContact N-O 2.99Å; L188-F201 PolarHBondContact O-N 3.07Å; L188-F201 VanDerWaalsContact O-N 3.08Å; V199-F201 WeakPolarHBondContact CG1-O 3.36Å
202	R	98	Very high	95.6	Very high	170 Å²	170	46.7 Å²	46.7	64%	0.642	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.2	169.6	175.3	-63.2	-172.6	176.2	-83.1	1.2	109.9	G186 T187 V199	G186-R202 CarbonylContact O-C 3.53Å; G186-R202 WeakPolarHBondContact O-CA 3.41Å; T187-R202 HydrophobicContact CG2-CG 4.19Å; V199-R202 HydrophobicContact CG1-CG 3.69Å
203	G	97.7	Very high	95.9	Very high	60 Å²	60	46.6 Å²	46.6	62%	0.619	27%	0.266	S	S	*	.			trans	82.2	24.3	176.4	0	0	0	0	0	113.8	G186 K207	G186-G203 PolarHBondContact O-N 2.92Å; G203-K207 WeakPolarHBondContact O-CE 3.48Å
204	L	98.4	Very high	96.3	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	25%	0.248	C	C	.	.			trans	-88.5	-8.5	-177.8	-55.7	-176.4	0	0	0	113.7	V117 W140 L181 M183 G186 L188 K207 L209	V117-L204 HydrophobicContact CG2-CD1 4.5Å; W140-L204 HydrophobicContact CD2-CD2 3.54Å; W140-L204 HydrophobicContact CE3-CD2 4.05Å; W140-L204 HydrophobicContact CG-CD2 3.96Å; W140-L204 HydrophobicContact CH2-CD2 4.36Å; W140-L204 HydrophobicContact CZ2-CD2 3.83Å; W140-L204 HydrophobicContact CZ3-CD2 4.44Å; L181-L204 HydrophobicContact CD1-CD1 3.88Å; M183-L204 WeakPolarHBondContact CE-O 3.26Å; G186-L204 WeakPolarHBondContact O-CB 3.44Å; G186-L204 PolarHBondContact O-N 2.94Å; L188-L204 HydrophobicContact CB-CD1 3.71Å; L204-K207 WeakPolarHBondContact O-CB 3.24Å; L204-K207 PolarHBondContact O-N 3.34Å; L204-L209 HydrophobicContact CB-CD1 3.74Å; L204-L209 HydrophobicContact CD1-CD1 4.04Å; L204-L209 HydrophobicContact CD2-CD1 4.05Å; L204-L209 HydrophobicContact CG-CD1 4.15Å
205	K	96.3	Very high	96.9	Very high	147 Å²	147	40.2 Å²	40.2	64%	0.639	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	143.1	-177	-169.2	169	-171.4	150.2	0	111.8	D184 K207	D184-K205 WeakPolarHBondContact O-CE 3.41Å; D184-K205 PolarHBondContact O-NZ 2.81Å; K205-K207 PolarHBondContact O-N 2.99Å
206	G	94.5	Very high	97.4	Very high	77 Å²	77	37.1 Å²	37.1	79%	0.794	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.4	3.5	179.4	0	0	0	0	0	114.6
207	K	98.3	Very high	97.6	Very high	77 Å²	77	42.2 Å²	42.2	34%	0.335	22%	0.223	S	C	.	.			trans	-95.8	164.1	174.3	-58.7	179.6	-175.6	-71.1	0	110.6	W140 M183 G203 L204 K205 L209	W140-K207 HydrophobicContact CH2-CD 3.56Å; W140-K207 HydrophobicContact CZ2-CD 4.06Å; W140-K207 HydrophobicContact CZ3-CD 4.31Å; M183-K207 WeakPolarHBondContact CE-O 3.3Å; G203-K207 WeakPolarHBondContact O-CE 3.48Å; L204-K207 WeakPolarHBondContact O-CB 3.24Å; L204-K207 PolarHBondContact O-N 3.34Å; K205-K207 PolarHBondContact O-N 2.99Å; K207-L209 HydrophobicContact CB-CD1 4.33Å; K207-L209 HydrophobicContact CB-CD2 3.96Å; K207-L209 HydrophobicContact CB-CG 3.87Å; K207-L209 HydrophobicContact CD-CD2 4.28Å
208	K	98.6	Very high	97.9	Very high	107 Å²	107	43.2 Å²	43.2	47%	0.465	23%	0.234	S	C	.	.			trans	-107.6	112.2	163.1	-175.2	176.6	-174.1	-171.1	0	108.4	Y93 T94 Y210	Y93-K208 WeakPolarHBondContact O-CA 3.38Å; T94-K208 HydrophobicContact CG2-CB 3.74Å; T94-K208 HydrophobicContact CG2-CD 4.3Å; T94-K208 HydrophobicContact CG2-CG 3.74Å; K208-Y210 HydrophobicContact CD-CE2 4.2Å; K208-Y210 WeakPolarHBondContact CE-OH 3.4Å; K208-Y210 HydrophobicContact CG-CE2 3.97Å; K208-Y210 PolarHBondContact NZ-OH 2.85Å; K208-Y210 VanDerWaalsContact NZ-OH 3.1Å
209	L	98.9	Very high	98.1	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-118.6	131.5	-170	-64.4	-178.9	0	0	0	111.8	G92 Y93 V117 T119 W140 L181 M183 L204 K207	G92-L209 CarbonylContact C-O 3.59Å; G92-L209 WeakPolarHBondContact CA-O 3.19Å; Y93-L209 PolarHBondContact N-O 2.7Å; Y93-L209 PolarHBondContact O-N 2.89Å; V117-L209 HydrophobicContact CB-CB 4.23Å; V117-L209 HydrophobicContact CG2-CB 4.41Å; V117-L209 HydrophobicContact CG2-CD1 3.92Å; T119-L209 HydrophobicContact CG2-CD2 4.04Å; W140-L209 HydrophobicContact CE3-CD2 4.11Å; W140-L209 HydrophobicContact CH2-CD2 4.26Å; W140-L209 HydrophobicContact CZ3-CD2 3.49Å; W140-L209 VanDerWaalsContact CZ3-CD2 3.49Å; L181-L209 HydrophobicContact CD1-CD1 4.28Å; L181-L209 HydrophobicContact CD2-CB 4.3Å; M183-L209 HydrophobicContact CE-CD1 4.23Å; M183-L209 HydrophobicContact CE-CG 4.29Å; M183-L209 HydrophobicContact SD-CB 4.29Å; M183-L209 HydrophobicContact SD-CD1 3.9Å; M183-L209 HydrophobicContact SD-CG 4.31Å; L204-L209 HydrophobicContact CB-CD1 3.74Å; L204-L209 HydrophobicContact CD1-CD1 4.04Å; L204-L209 HydrophobicContact CD2-CD1 4.05Å; L204-L209 HydrophobicContact CG-CD1 4.15Å; K207-L209 HydrophobicContact CB-CD1 4.33Å; K207-L209 HydrophobicContact CB-CD2 3.96Å; K207-L209 HydrophobicContact CB-CG 3.87Å; K207-L209 HydrophobicContact CD-CD2 4.28Å
210	Y	98.9	Very high	98.2	Very high	31 Å²	31	45.6 Å²	45.6	12%	0.122	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	141	-179.3	-62.6	-99.2	0	0	0	109.3	G89 G92 V117 G118 K208 I212	G89-Y210 WeakPolarHBondContact O-CD1 3.49Å; G92-Y210 VanDerWaalsContact CA-CD1 3.42Å; G92-Y210 VanDerWaalsContact CA-CE1 3.4Å; G92-Y210 VanDerWaalsContact N-CE1 3.26Å; V117-Y210 CarbonylContact C-O 3.48Å; V117-Y210 WeakPolarHBondContact CA-O 3.3Å; G118-Y210 PolarHBondContact N-O 3.41Å; G118-Y210 PolarHBondContact O-N 2.83Å; K208-Y210 HydrophobicContact CD-CE2 4.2Å; K208-Y210 WeakPolarHBondContact CE-OH 3.4Å; K208-Y210 HydrophobicContact CG-CE2 3.97Å; K208-Y210 PolarHBondContact NZ-OH 2.85Å; K208-Y210 VanDerWaalsContact NZ-OH 3.1Å; Y210-I212 PolarHBondContact O-N 3.01Å
211	P	98.9	Very high	98.3	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.7	134.7	163.6	-23.8	34.3	0	0	0	109.7	R88 G89 V91 Y93 W100 I224	R88-P211 CarbonylContact C-O 3.4Å; R88-P211 VanDerWaalsContact CA-O 3.26Å; R88-P211 WeakPolarHBondContact CA-O 3.01Å; G89-P211 PolarHBondContact N-O 3.43Å; V91-P211 WeakPolarHBondContact O-CD 3.07Å; Y93-P211 HydrophobicContact CE2-CG 3.78Å; W100-P211 HydrophobicContact CD2-CB 4.42Å; W100-P211 HydrophobicContact CD2-CG 4.11Å; W100-P211 HydrophobicContact CE3-CG 4.3Å; W100-P211 HydrophobicContact CH2-CB 4.48Å; W100-P211 HydrophobicContact CH2-CG 4.04Å; W100-P211 HydrophobicContact CZ2-CB 3.8Å; W100-P211 HydrophobicContact CZ2-CG 3.82Å; W100-P211 HydrophobicContact CZ3-CG 4.27Å; P211-I224 HydrophobicContact CB-CD1 3.81Å; P211-I224 HydrophobicContact CG-CD1 4.26Å
212	I	98.9	Very high	98.3	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.01	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	145.7	179.2	-167.8	175.3	0	0	0	110.2	A86 I87 R88 G116 A122 L124 V133 Y210	A86-I212 HydrophobicContact CB-CD1 4.41Å; A86-I212 HydrophobicContact CB-CG1 4.35Å; I87-I212 WeakPolarHBondContact O-CA 3.42Å; I87-I212 WeakPolarHBondContact O-CG1 3.28Å; R88-I212 HydrophobicContact CG-CB 4.1Å; R88-I212 HydrophobicContact CG-CD1 3.96Å; R88-I212 HydrophobicContact CG-CG1 4Å; G116-I212 CarbonylContact C-O 3.54Å; G116-I212 PolarHBondContact N-O 3.34Å; G116-I212 PolarHBondContact O-N 3.25Å; G116-I212 VanDerWaalsContact O-O 3.14Å; A122-I212 HydrophobicContact CB-CD1 4.4Å; L124-I212 HydrophobicContact CD2-CD1 3.56Å; L124-I212 HydrophobicContact CD2-CG1 4.29Å; V133-I212 HydrophobicContact CG1-CG2 3.76Å; V133-I212 HydrophobicContact CG2-CB 4.48Å; V133-I212 HydrophobicContact CG2-CD1 3.94Å; V133-I212 HydrophobicContact CG2-CG1 3.85Å; V133-I212 HydrophobicContact CG2-CG2 3.93Å; Y210-I212 PolarHBondContact O-N 3.01Å
213	V	98.9	Very high	98.3	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	151.8	168	-60	0	0	0	0	109.9	W56 F75 A86 I87 I102 W104 V114 V115 I222	W56-V213 HydrophobicContact CH2-CG1 3.86Å; W56-V213 HydrophobicContact CH2-CG2 3.98Å; W56-V213 HydrophobicContact CZ2-CG1 4.39Å; W56-V213 HydrophobicContact CZ2-CG2 4.24Å; F75-V213 HydrophobicContact CE1-CG2 3.46Å; F75-V213 VanDerWaalsContact CE1-CG2 3.46Å; F75-V213 HydrophobicContact CZ-CG2 3.57Å; A86-V213 WeakPolarHBondContact CA-O 3.34Å; A86-V213 WeakPolarHBondContact CB-O 3.21Å; I87-V213 HydrophobicContact CG2-CG2 4.21Å; I87-V213 PolarHBondContact N-O 3.12Å; I87-V213 PolarHBondContact O-N 2.61Å; I102-V213 HydrophobicContact CD1-CG1 4.42Å; W104-V213 HydrophobicContact CZ3-CB 4.17Å; V114-V213 CarbonylContact O-C 3.53Å; V114-V213 WeakPolarHBondContact O-CA 3.3Å; V114-V213 WeakPolarHBondContact O-CB 3.23Å; V115-V213 HydrophobicContact CB-CG1 4.3Å; V115-V213 HydrophobicContact CG1-CG1 4.21Å; V115-V213 HydrophobicContact CG2-CG1 3.93Å; V213-I222 HydrophobicContact CG2-CG2 4.47Å
214	S	98.9	Very high	98.4	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	131.6	165.7	56.6	0	0	0	0	111.3	D85 W104 V114 V133	D85-S214 CarbonylContact O-C 3.53Å; D85-S214 WeakPolarHBondContact O-CA 3.47Å; W104-S214 WeakPolarHBondContact CH2-O 3.48Å; V114-S214 WeakPolarHBondContact CB-OG 3.48Å; V114-S214 PolarHBondContact N-O 2.97Å; V114-S214 VanDerWaalsContact N-O 3.11Å; V114-S214 PolarHBondContact O-N 3.32Å; V133-S214 PolarHBondContact N-OG 3.48Å
215	A	98.8	Very high	98.4	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	149.4	-175	0	0	0	0	0	112.2	R77 D85 W104 I222	R77-A215 PolarHBondContact NE-O 3.23Å; D85-A215 PolarHBondContact N-O 3.42Å; D85-A215 PolarHBondContact O-N 2.89Å; W104-A215 HydrophobicContact CH2-CB 3.58Å; W104-A215 HydrophobicContact CZ2-CB 3.57Å; A215-I222 HydrophobicContact CB-CD1 3.99Å
216	V	98.7	Very high	98.5	Very high	10 Å²	10	38 Å²	38	6%	0.061	19%	0.188	C	C	.	.			trans	-120.1	-12.2	177.1	-59.2	0	0	0	0	113.4	R77 T84 H112 Y129	R77-V216 VanDerWaalsContact NH1-C 3.33Å; R77-V216 PolarHBondContact NH1-O 2.94Å; T84-V216 HydrophobicContact CG2-CG1 4Å; H112-V216 HydrophobicContact CB-CG1 4.09Å; H112-V216 HydrophobicContact CB-CG2 4.44Å; H112-V216 WeakPolarHBondContact O-CG2 3.4Å; Y129-V216 HydrophobicContact CD1-CB 3.77Å; Y129-V216 HydrophobicContact CD1-CG1 3.96Å; Y129-V216 HydrophobicContact CE1-CB 4.39Å; Y129-V216 HydrophobicContact CG-CB 4.43Å; Y129-V216 HydrophobicContact CG-CG1 4.48Å
217	W	98.4	Very high	98.7	Very high	115 Å²	115	35 Å²	35	44%	0.436	15%	0.154	S	C	.	.	S	Bend	trans	-80	133.9	-173.8	-169.5	-95.8	0	0	0	111.5	R77 Q108 G110 C220	R77-W217 WeakPolarHBondContact CD-O 3.48Å; R77-W217 PolarHBondContact NH1-O 2.92Å; Q108-W217 HydrophobicContact CB-CG 4.45Å; Q108-W217 WeakPolarHBondContact O-CB 3.43Å; G110-W217 VanDerWaalsContact CA-CE3 3.44Å; W217-C220 HydrophobicContact CB-CB 4.08Å; W217-C220 HydrophobicContact CG-CB 4.46Å; W217-C220 PolarHBondContact O-SG 2.96Å; W217-C220 VanDerWaalsContact O-SG 3.36Å
218	G	98.3	Very high	98.6	Very high	23 Å²	23	32.3 Å²	32.3	24%	0.237	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	135.4	175.4	0	0	0	0	0	110.8	C220	G218-C220 PolarHBondContact O-N 3.21Å
219	H	98.3	Very high	98.5	Very high	105 Å²	105	28.4 Å²	28.4	49%	0.486	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	21	-178.2	-48.8	-80.6	0	0	0	115.2	H76 R77 P79	H76-H219 VanDerWaalsContact CE1-CA 3.47Å; H76-H219 WeakPolarHBondContact CE1-CA 3.48Å; H76-H219 AromaticContact CE1-ND1 3.75Å; H76-H219 AromaticContact NE2-ND1 3.58Å; R77-H219 VanDerWaalsContact O-CA 3.28Å; R77-H219 WeakPolarHBondContact O-CA 3.24Å; R77-H219 PolarHBondContact O-N 3.28Å; P79-H219 WeakPolarHBondContact CG-NE2 3.18Å
220	C	98.6	Very high	98.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.138	C	C	.	.			trans	-67.8	139.1	169.1	65.4	0	0	0	0	110.2	H76 R77 Q108 W217 G218 I222	H76-C220 WeakPolarHBondContact CA-O 2.99Å; R77-C220 VanDerWaalsContact CB-SG 3.56Å; R77-C220 PolarHBondContact N-O 2.65Å; Q108-C220 HydrophobicContact CB-CB 3.86Å; Q108-C220 WeakPolarHBondContact O-CB 3.4Å; W217-C220 HydrophobicContact CB-CB 4.08Å; W217-C220 HydrophobicContact CG-CB 4.46Å; W217-C220 PolarHBondContact O-SG 2.96Å; W217-C220 VanDerWaalsContact O-SG 3.36Å; G218-C220 PolarHBondContact O-N 3.21Å; C220-I222 HydrophobicContact CB-CD1 4.49Å
221	E	98.8	Very high	97.7	Very high	70 Å²	70	32.2 Å²	32.2	33%	0.327	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	128.5	169.6	-70.5	-168.1	-179.5	0	0	108.8	K68 V74 F75 H76	K68-E221 IonicContact NZ-OE1 3.71Å; K68-E221 PolarHBondContact NZ-OE1 3.37Å; K68-E221 IonicContact NZ-OE2 3.01Å; K68-E221 PolarHBondContact NZ-OE2 3.42Å; V74-E221 HydrophobicContact CG1-CB 3.82Å; V74-E221 HydrophobicContact CG1-CG 4.27Å; F75-E221 VanDerWaalsContact O-CA 3.31Å; F75-E221 WeakPolarHBondContact O-CA 3.43Å; H76-E221 HydrophobicContact CB-CG 4.36Å; H76-E221 IonicContact ND1-OE1 3.04Å
222	I	98.8	Very high	96.8	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	120	-176.5	-62.4	144.2	0	0	0	108.5	W56 V74 F75 I102 W104 V213 A215 C220	W56-I222 HydrophobicContact CZ2-CG2 4.13Å; W56-I222 PolarHBondContact NE1-O 3.22Å; W56-I222 VanDerWaalsContact NE1-O 3.08Å; V74-I222 WeakPolarHBondContact CA-O 3.26Å; F75-I222 HydrophobicContact CD1-CB 4.11Å; F75-I222 HydrophobicContact CE1-CB 3.57Å; F75-I222 HydrophobicContact CE1-CD1 3.86Å; F75-I222 HydrophobicContact CE1-CG1 4.32Å; F75-I222 HydrophobicContact CE1-CG2 3.93Å; F75-I222 HydrophobicContact CE2-CD1 3.76Å; F75-I222 HydrophobicContact CZ-CB 3.85Å; F75-I222 HydrophobicContact CZ-CD1 3.2Å; F75-I222 HydrophobicContact CZ-CG1 4.1Å; F75-I222 HydrophobicContact CZ-CG2 4.47Å; F75-I222 PolarHBondContact N-O 3.17Å; F75-I222 VanDerWaalsContact N-O 3.14Å; F75-I222 PolarHBondContact O-N 2.67Å; I102-I222 HydrophobicContact CG2-CG2 4Å; W104-I222 HydrophobicContact CB-CG1 4.19Å; W104-I222 HydrophobicContact CB-CG2 4.37Å; W104-I222 HydrophobicContact CD2-CD1 3.75Å; W104-I222 HydrophobicContact CD2-CG1 3.53Å; W104-I222 HydrophobicContact CE3-CD1 4.01Å; W104-I222 HydrophobicContact CE3-CG1 4.03Å; W104-I222 HydrophobicContact CE3-CG2 4.37Å; W104-I222 HydrophobicContact CG-CD1 4.33Å; W104-I222 HydrophobicContact CG-CG1 3.61Å; W104-I222 HydrophobicContact CH2-CD1 3.88Å; W104-I222 HydrophobicContact CZ2-CD1 3.62Å; W104-I222 HydrophobicContact CZ2-CG1 4.3Å; W104-I222 HydrophobicContact CZ3-CD1 4.07Å; V213-I222 HydrophobicContact CG2-CG2 4.47Å; A215-I222 HydrophobicContact CB-CD1 3.99Å; C220-I222 HydrophobicContact CB-CD1 4.49Å
223	R	98.9	Very high	95.7	Very high	98 Å²	98	41.8 Å²	41.8	37%	0.37	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	136.2	178.6	-170.4	-176.3	-69.2	-120.7	5.9	110.4	N71 L73 V74 I102 N103	N71-R223 PolarHBondContact ND2-NH1 3.49Å; N71-R223 VanDerWaalsContact ND2-NH1 3.14Å; N71-R223 PolarHBondContact ND2-NH2 3.02Å; L73-R223 HydrophobicContact CB-CG 3.94Å; L73-R223 CarbonylContact O-C 3.54Å; L73-R223 VanDerWaalsContact O-CA 3.28Å; L73-R223 WeakPolarHBondContact O-CA 3.42Å; V74-R223 HydrophobicContact CG2-CB 3.84Å; V74-R223 HydrophobicContact CG2-CG 3.83Å; I102-R223 WeakPolarHBondContact CA-O 3.44Å; N103-R223 HydrophobicContact CB-CB 4.17Å; N103-R223 PolarHBondContact N-O 2.97Å; N103-R223 PolarHBondContact O-N 2.81Å
224	I	98.9	Very high	94.4	Very high	3 Å²	3	47.6 Å²	47.6	2%	0.015	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	136.6	163.4	-170.6	166.9	0	0	0	110	W56 L73 W100 E101 I102 P211	W56-I224 HydrophobicContact CD2-CB 4.18Å; W56-I224 HydrophobicContact CD2-CG2 3.7Å; W56-I224 VanDerWaalsContact CE2-CG2 3.48Å; W56-I224 HydrophobicContact CE3-CD1 4.45Å; W56-I224 HydrophobicContact CE3-CG2 4.44Å; W56-I224 HydrophobicContact CG-CG2 3.79Å; W56-I224 HydrophobicContact CH2-CB 4.19Å; W56-I224 HydrophobicContact CH2-CD1 3.94Å; W56-I224 HydrophobicContact CZ2-CB 3.58Å; W56-I224 HydrophobicContact CZ2-CD1 4.22Å; W56-I224 HydrophobicContact CZ2-CG1 4.38Å; W56-I224 HydrophobicContact CZ2-CG2 4.06Å; W56-I224 HydrophobicContact CZ3-CD1 4.08Å; L73-I224 WeakPolarHBondContact CB-O 3.34Å; L73-I224 PolarHBondContact O-N 3.09Å; W100-I224 HydrophobicContact CB-CG1 4.29Å; W100-I224 HydrophobicContact CG-CD1 4.19Å; W100-I224 HydrophobicContact CG-CG1 4.32Å; E101-I224 WeakPolarHBondContact O-CA 3.48Å; I102-I224 HydrophobicContact CD1-CB 4.06Å; I102-I224 HydrophobicContact CD1-CD1 4.23Å; I102-I224 HydrophobicContact CD1-CG1 3.94Å; P211-I224 HydrophobicContact CB-CD1 3.81Å; P211-I224 HydrophobicContact CG-CD1 4.26Å
225	R	98.7	Very high	93.3	Very high	64 Å²	64	49.4 Å²	49.4	24%	0.242	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	110.4	172.9	-176.7	174.3	64	94.4	-1.8	109.6	Q51 W100 E101 I227	Q51-R225 HydrophobicContact CG-CG 4.17Å; W100-R225 CarbonylContact C-O 3.35Å; W100-R225 WeakPolarHBondContact CA-O 3.4Å; E101-R225 HydrophobicContact CB-CB 4.3Å; E101-R225 PolarHBondContact N-O 2.97Å; E101-R225 PolarHBondContact O-N 3.13Å; E101-R225 IonicContact OE1-NH2 2.65Å; E101-R225 PolarHBondContact OE1-NH2 3.12Å; E101-R225 IonicContact OE2-CZ 2.85Å; E101-R225 VanDerWaalsContact OE2-CZ 3.28Å; E101-R225 IonicContact OE2-NE 3.58Å; E101-R225 PolarHBondContact OE2-NE 3.1Å; E101-R225 IonicContact OE2-NH2 3.66Å; E101-R225 PolarHBondContact OE2-NH2 3.45Å; R225-I227 VanDerWaalsContact CZ-CD1 3.41Å; R225-I227 VanDerWaalsContact NH1-CD1 3.3Å; R225-I227 PolarHBondContact O-N 3.2Å
226	Y	98.8	Very high	92.6	Very high	15 Å²	15	51.5 Å²	51.5	6%	0.059	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	128.3	174.1	-172.1	-107.7	0	0	0	110	A46 T50 Q51 H54 Y93 H98 W100 N228 G229	A46-Y226 HydrophobicContact CB-CD1 3.96Å; A46-Y226 HydrophobicContact CB-CE1 4.49Å; T50-Y226 HydrophobicContact CG2-CD1 4.07Å; T50-Y226 HydrophobicContact CG2-CE1 4.29Å; Q51-Y226 WeakPolarHBondContact CG-O 2.89Å; H54-Y226 HydrophobicContact CB-CD1 4.41Å; H54-Y226 HydrophobicContact CB-CD2 4.01Å; H54-Y226 HydrophobicContact CB-CG 3.78Å; H54-Y226 AromaticContact CE1-CZ 3.81Å; H54-Y226 AromaticContact CG-CD2 3.97Å; H54-Y226 AromaticContact CG-CG 3.83Å; H54-Y226 AromaticContact ND1-CD2 3.69Å; H54-Y226 AromaticContact ND1-CE2 3.62Å; H54-Y226 AromaticContact ND1-CG 3.98Å; H54-Y226 AromaticContact ND1-CZ 3.84Å; Y93-Y226 HydrophobicContact CE1-CE2 4.23Å; Y93-Y226 AromaticContact CZ-CE2 4Å; Y93-Y226 WeakPolarHBondContact OH-CD2 3.37Å; Y93-Y226 WeakPolarHBondContact OH-CE2 3.33Å; H98-Y226 HydrophobicContact CB-CE2 4.26Å; H98-Y226 AromaticContact ND1-CZ 3.9Å; H98-Y226 PolarHBondContact ND1-OH 3.26Å; W100-Y226 HydrophobicContact CB-CD2 4.39Å; Y226-N228 VanDerWaalsContact CZ-C 3.43Å; Y226-N228 PolarHBondContact OH-O 3.34Å; Y226-G229 VanDerWaalsContact OH-CA 3.24Å; Y226-G229 WeakPolarHBondContact OH-CA 3.44Å; Y226-G229 PolarHBondContact OH-N 3.18Å; Y226-G229 VanDerWaalsContact OH-N 3.17Å
227	I	98.3	Very high	91.9	Very high	15 Å²	15	57.3 Å²	57.3	8%	0.077	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-60.8	-177.9	-58.1	-54.5	0	0	0	109.5	L41 A46 V99 E101 L178 R225	L41-I227 HydrophobicContact CD2-CG2 4.46Å; A46-I227 WeakPolarHBondContact CB-O 3.32Å; A46-I227 PolarHBondContact N-O 3.38Å; V99-I227 HydrophobicContact CB-CB 4.23Å; V99-I227 HydrophobicContact CG1-CB 4.1Å; V99-I227 HydrophobicContact CG1-CG1 4.06Å; V99-I227 WeakPolarHBondContact O-CA 3.47Å; V99-I227 WeakPolarHBondContact O-CB 3.35Å; V99-I227 PolarHBondContact O-N 2.85Å; E101-I227 HydrophobicContact CB-CD1 4.05Å; E101-I227 HydrophobicContact CB-CG1 4.46Å; L178-I227 HydrophobicContact CD2-CD1 4.43Å; L178-I227 HydrophobicContact CD2-CG1 4.13Å; R225-I227 VanDerWaalsContact CZ-CD1 3.41Å; R225-I227 VanDerWaalsContact NH1-CD1 3.3Å; R225-I227 PolarHBondContact O-N 3.2Å
228	N	97.4	Very high	91.4	Very high	20 Å²	20	57.7 Å²	57.7	11%	0.107	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.5	171.4	178.7	-93	-35.1	0	0	0	110.7	L40 P44 A46 V99 Y226	L40-N228 HydrophobicContact CD2-CB 3.58Å; L40-N228 HydrophobicContact CG-CB 3.84Å; P44-N228 PolarHBondContact O-ND2 2.79Å; A46-N228 PolarHBondContact N-OD1 3.42Å; V99-N228 PolarHBondContact N-O 2.67Å; V99-N228 PolarHBondContact O-N 2.85Å; Y226-N228 VanDerWaalsContact CZ-C 3.43Å; Y226-N228 PolarHBondContact OH-O 3.34Å
229	G	95.4	Very high	90.7	Very high	25 Å²	25	58.5 Å²	58.5	26%	0.258	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	156.8	167.9	0	0	0	0	0	112.1	L97 Y226	L97-G229 CarbonylContact O-C 3.53Å; L97-G229 WeakPolarHBondContact O-CA 3.45Å; Y226-G229 VanDerWaalsContact OH-CA 3.24Å; Y226-G229 WeakPolarHBondContact OH-CA 3.44Å; Y226-G229 PolarHBondContact OH-N 3.18Å; Y226-G229 VanDerWaalsContact OH-N 3.17Å
230	L	93.5	Very high	90.1	Very high	19 Å²	19	57.2 Å²	57.2	10%	0.099	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	123.3	169.7	-72.7	177.8	0	0	0	109.1	R36 L39 L40 M43 G96 L97 L235	R36-L230 HydrophobicContact CB-CD1 4.42Å; R36-L230 WeakPolarHBondContact O-CD1 3.44Å; L39-L230 HydrophobicContact CD2-CD1 4.35Å; L40-L230 HydrophobicContact CB-CD1 3.76Å; L40-L230 HydrophobicContact CB-CG 4.03Å; L40-L230 HydrophobicContact CD1-CB 4.4Å; L40-L230 HydrophobicContact CD1-CD1 4.38Å; L40-L230 HydrophobicContact CD1-CG 4.02Å; L40-L230 HydrophobicContact CG-CD1 4.45Å; L40-L230 HydrophobicContact CG-CG 4.2Å; M43-L230 HydrophobicContact SD-CD2 3.81Å; G96-L230 CarbonylContact C-O 3.56Å; G96-L230 WeakPolarHBondContact CA-O 3.32Å; L97-L230 HydrophobicContact CB-CB 4.4Å; L97-L230 PolarHBondContact N-O 2.97Å; L97-L230 PolarHBondContact O-N 3.16Å; L230-L235 HydrophobicContact CD2-CD2 4.34Å
231	D	87.8	Confident	89.6	Confident	93 Å²	93	60.4 Å²	60.4	50%	0.497	32%	0.322	S	S	.	.			trans	-64.2	157.6	173.5	-83.3	-52.6	0	0	0	111.8	R36 R95 E233	R36-D231 PolarHBondContact NH2-O 2.79Å; R95-D231 IonicContact NE-OD1 2.81Å; R95-D231 IonicContact NH2-OD1 3.92Å; D231-E233 PolarHBondContact O-N 2.66Å
232	P	79.1	Confident	89.2	Confident	55 Å²	55	58 Å²	58	36%	0.357	31%	0.31	S	S	.	.	S	Bend	trans	-61.3	-14.4	-175.7	-15.1	25.1	0	0	0	114.3	R36 R95 D184	R36-P232 PolarHBondContact NH1-O 3.17Å; R95-P232 HydrophobicContact CB-CG 3.92Å; R95-P232 HydrophobicContact CG-CG 4.14Å; D184-P232 VanDerWaalsContact OD1-CG 3.31Å; D184-P232 WeakPolarHBondContact OD1-CG 3.43Å; D184-P232 VanDerWaalsContact OD2-CA 3.31Å; D184-P232 WeakPolarHBondContact OD2-CA 3.43Å; D184-P232 WeakPolarHBondContact OD2-CB 3.38Å
233	E	75.5	Confident	88.4	Confident	147 Å²	147	60.3 Å²	60.3	69%	0.687	32%	0.319	S	S	*	.	S	Bend	trans	-61.5	150.8	-173.8	-64.2	-173.5	176.2	0	0	112.5	R36 D231 L235	R36-E233 PolarHBondContact NH1-O 2.85Å; D231-E233 PolarHBondContact O-N 2.66Å; E233-L235 PolarHBondContact O-N 3.31Å
234	P	72.9	Confident	87.9	Confident	122 Å²	122	59.5 Å²	59.5	79%	0.792	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-56	132.3	170.2	-19.7	31	0	0	0	109.6
235	L	75.9	Confident	87.3	Confident	39 Å²	39	61.9 Å²	61.9	20%	0.204	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-59.6	143.3	173.6	-64.2	165.5	0	0	0	109.7	L39 L230 E233 L240	L39-L235 HydrophobicContact CD2-CD1 3.27Å; L39-L235 HydrophobicContact CD2-CD2 3.4Å; L39-L235 HydrophobicContact CD2-CG 3.9Å; L230-L235 HydrophobicContact CD2-CD2 4.34Å; E233-L235 PolarHBondContact O-N 3.31Å; L235-L240 HydrophobicContact CB-CD2 4.03Å; L235-L240 HydrophobicContact CB-CG 4.08Å; L235-L240 HydrophobicContact CD1-CD2 3.84Å
236	S	83.3	Confident	86.8	Confident	43 Å²	43	60.3 Å²	60.3	30%	0.301	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-62.4	149.7	175.8	78.2	0	0	0	0	110.1	M238 D239 L240	S236-M238 PolarHBondContact O-N 3.42Å; S236-M238 VanDerWaalsContact O-N 3.15Å; S236-D239 WeakPolarHBondContact CB-OD2 3.23Å; S236-D239 PolarHBondContact O-N 2.79Å; S236-D239 PolarHBondContact OG-N 3.23Å; S236-D239 VanDerWaalsContact OG-N 3.13Å; S236-D239 PolarHBondContact OG-OD2 3.04Å; S236-L240 PolarHBondContact O-N 3.07Å; S236-L240 VanDerWaalsContact O-N 3.09Å
237	L	85.3	Confident	86.1	Confident	133 Å²	133	64 Å²	64	70%	0.696	36%	0.361	S	S	*	.	H	α-helix	trans	-54.8	-34.3	173.8	-179.7	61.2	0	0	0	111.1	L240 C241	L237-L240 PolarHBondContact O-N 2.91Å; L237-C241 WeakPolarHBondContact O-CB 3.32Å; L237-C241 PolarHBondContact O-N 2.88Å; L237-C241 PolarHBondContact O-SG 2.98Å
238	M	87.3	Confident	85.5	Confident	123 Å²	123	67 Å²	67	61%	0.606	39%	0.387	S	S	*	.	H	α-helix	trans	-61.4	-45.2	176.1	-61.9	-173.4	-71.7	0	0	111.7	S236 L240 C241 R242 Y269	S236-M238 PolarHBondContact O-N 3.42Å; S236-M238 VanDerWaalsContact O-N 3.15Å; M238-L240 PolarHBondContact O-N 3Å; M238-C241 PolarHBondContact O-N 3.41Å; M238-R242 WeakPolarHBondContact O-CB 3.46Å; M238-R242 PolarHBondContact O-N 3.04Å; M238-Y269 HydrophobicContact CB-CE1 4.19Å; M238-Y269 VanDerWaalsContact CB-OH 3.26Å; M238-Y269 WeakPolarHBondContact CB-OH 3.49Å; M238-Y269 PolarHBondContact O-OH 3.34Å; M238-Y269 VanDerWaalsContact O-OH 3.05Å
239	D	83.9	Confident	85	Confident	39 Å²	39	67.3 Å²	67.3	21%	0.209	39%	0.389	C	S	.	.	H	α-helix	trans	-66.7	-39.3	180	-61.6	-48.2	0	0	0	111.6	S236 R242 R243 Y269	S236-D239 WeakPolarHBondContact CB-OD2 3.23Å; S236-D239 PolarHBondContact O-N 2.79Å; S236-D239 PolarHBondContact OG-N 3.23Å; S236-D239 VanDerWaalsContact OG-N 3.13Å; S236-D239 PolarHBondContact OG-OD2 3.04Å; D239-R242 PolarHBondContact O-N 2.96Å; D239-R242 IonicContact OD1-CZ 3.04Å; D239-R242 IonicContact OD1-NH1 3.8Å; D239-R242 IonicContact OD1-NH2 2.79Å; D239-R242 PolarHBondContact OD1-NH2 3.14Å; D239-R243 WeakPolarHBondContact O-CB 3.38Å; D239-R243 PolarHBondContact O-N 3.06Å; D239-Y269 WeakPolarHBondContact CA-OH 3.38Å; D239-Y269 PolarHBondContact N-OH 2.83Å; D239-Y269 VanDerWaalsContact N-OH 3.15Å; D239-Y269 PolarHBondContact OD1-OH 3.03Å; D239-Y269 VanDerWaalsContact OD1-OH 3.13Å
240	L	84.8	Confident	84.4	Confident	79 Å²	79	67.5 Å²	67.5	41%	0.414	39%	0.391	S	S	.	.	H	α-helix	trans	-63.4	-44.5	174.1	-65.4	176.1	0	0	0	111.5	L235 S236 L237 M238 R243 S244	L235-L240 HydrophobicContact CB-CD2 4.03Å; L235-L240 HydrophobicContact CB-CG 4.08Å; L235-L240 HydrophobicContact CD1-CD2 3.84Å; S236-L240 PolarHBondContact O-N 3.07Å; S236-L240 VanDerWaalsContact O-N 3.09Å; L237-L240 PolarHBondContact O-N 2.91Å; M238-L240 PolarHBondContact O-N 3Å; L240-R243 PolarHBondContact O-N 3.14Å; L240-S244 WeakPolarHBondContact O-CB 3.39Å; L240-S244 PolarHBondContact O-N 3.29Å
241	C	88.4	Confident	83.8	Confident	67 Å²	67	74.4 Å²	74.4	45%	0.453	42%	0.416	S	S	.	.	H	α-helix	trans	-62.6	-46.8	175.5	-74.5	0	0	0	0	111.6	L237 M238 R243 S244 V245	L237-C241 WeakPolarHBondContact O-CB 3.32Å; L237-C241 PolarHBondContact O-N 2.88Å; L237-C241 PolarHBondContact O-SG 2.98Å; M238-C241 PolarHBondContact O-N 3.41Å; C241-R243 VanDerWaalsContact C-N 3.29Å; C241-R243 PolarHBondContact O-N 3.3Å; C241-S244 PolarHBondContact O-N 3Å; C241-V245 WeakPolarHBondContact O-CG2 3.38Å; C241-V245 PolarHBondContact O-N 2.93Å
242	R	89.4	Confident	83.5	Confident	20 Å²	20	77.4 Å²	77.4	8%	0.075	43%	0.432	C	S	.	.	H	α-helix	trans	-55.4	-47.4	175.7	173.4	173	66.8	-155.7	-8.2	111.2	M238 D239 V245 R246 Y269 L270 Y272	M238-R242 WeakPolarHBondContact O-CB 3.46Å; M238-R242 PolarHBondContact O-N 3.04Å; D239-R242 PolarHBondContact O-N 2.96Å; D239-R242 IonicContact OD1-CZ 3.04Å; D239-R242 IonicContact OD1-NH1 3.8Å; D239-R242 IonicContact OD1-NH2 2.79Å; D239-R242 PolarHBondContact OD1-NH2 3.14Å; R242-V245 PolarHBondContact O-N 2.67Å; R242-R246 HydrophobicContact CG-CG 4.49Å; R242-R246 WeakPolarHBondContact O-CG 3.36Å; R242-R246 PolarHBondContact O-N 3.11Å; R242-Y269 HydrophobicContact CB-CD1 4.36Å; R242-Y269 HydrophobicContact CB-CE1 3.65Å; R242-Y269 WeakPolarHBondContact CD-O 3.31Å; R242-Y269 HydrophobicContact CG-CE1 4.36Å; R242-L270 HydrophobicContact CB-CD2 4.1Å; R242-L270 HydrophobicContact CG-CD2 3.98Å; R242-Y272 VanDerWaalsContact CZ-CZ 3.47Å; R242-Y272 VanDerWaalsContact NE-CZ 3.34Å; R242-Y272 PolarHBondContact NE-OH 2.94Å
243	R	83.5	Confident	83.8	Confident	48 Å²	48	80.8 Å²	80.8	18%	0.181	44%	0.437	C	S	.	.	H	α-helix	trans	-60.2	-50.4	177.4	-178.2	-176.4	173.2	-169.5	2.2	111.6	S35 D38 L39 D239 L240 C241 V245 R246 V247	S35-R243 PolarHBondContact O-NH1 3.14Å; S35-R243 PolarHBondContact O-NH2 2.93Å; D38-R243 IonicContact OD2-NH2 3.74Å; L39-R243 HydrophobicContact CD1-CB 4.03Å; L39-R243 HydrophobicContact CD1-CG 4.37Å; D239-R243 WeakPolarHBondContact O-CB 3.38Å; D239-R243 PolarHBondContact O-N 3.06Å; L240-R243 PolarHBondContact O-N 3.14Å; C241-R243 VanDerWaalsContact C-N 3.29Å; C241-R243 PolarHBondContact O-N 3.3Å; R243-V245 VanDerWaalsContact C-N 3.26Å; R243-V245 PolarHBondContact O-N 2.77Å; R243-R246 PolarHBondContact O-N 3.5Å; R243-R246 VanDerWaalsContact O-N 3.13Å; R243-V247 HydrophobicContact CG-CG2 4.07Å; R243-V247 WeakPolarHBondContact O-CB 3.46Å; R243-V247 WeakPolarHBondContact O-CG2 3.48Å; R243-V247 PolarHBondContact O-N 3.32Å
244	S	86.9	Confident	84.3	Confident	81 Å²	81	75.2 Å²	75.2	57%	0.566	41%	0.412	S	S	*	.	H	α-helix	trans	-54.9	-44.1	-178.6	-177.8	0	0	0	0	111.6	L240 C241 A248	L240-S244 WeakPolarHBondContact O-CB 3.39Å; L240-S244 PolarHBondContact O-N 3.29Å; C241-S244 PolarHBondContact O-N 3Å; S244-A248 WeakPolarHBondContact O-CB 3.48Å; S244-A248 PolarHBondContact O-N 3.42Å
245	V	87.9	Confident	84.9	Confident	53 Å²	53	73.7 Å²	73.7	32%	0.321	40%	0.404	S	S	.	.	H	α-helix	trans	-64.7	-46.9	176.4	174.7	0	0	0	0	111.9	C241 R242 R243 V247 A248 L249 L270	C241-V245 WeakPolarHBondContact O-CG2 3.38Å; C241-V245 PolarHBondContact O-N 2.93Å; R242-V245 PolarHBondContact O-N 2.67Å; R243-V245 VanDerWaalsContact C-N 3.26Å; R243-V245 PolarHBondContact O-N 2.77Å; V245-V247 PolarHBondContact O-N 3.2Å; V245-A248 PolarHBondContact O-N 2.75Å; V245-L249 HydrophobicContact CG1-CD1 3.82Å; V245-L249 WeakPolarHBondContact O-CG 3.46Å; V245-L249 PolarHBondContact O-N 3.46Å; V245-L270 HydrophobicContact CB-CD2 3.92Å; V245-L270 HydrophobicContact CG1-CD1 3.84Å; V245-L270 HydrophobicContact CG1-CD2 3.96Å; V245-L270 HydrophobicContact CG2-CD2 4.4Å
246	R	88.3	Confident	85.5	Confident	31 Å²	31	75.5 Å²	75.5	12%	0.117	41%	0.412	C	S	.	.	H	α-helix	trans	-63.9	-39.2	179.8	-71.1	175.2	68.6	95.1	-4.2	112.4	R242 R243 L249 G250 L254 L270	R242-R246 HydrophobicContact CG-CG 4.49Å; R242-R246 WeakPolarHBondContact O-CG 3.36Å; R242-R246 PolarHBondContact O-N 3.11Å; R243-R246 PolarHBondContact O-N 3.5Å; R243-R246 VanDerWaalsContact O-N 3.13Å; R246-L249 PolarHBondContact O-N 3.31Å; R246-G250 PolarHBondContact O-N 3.01Å; R246-L254 HydrophobicContact CB-CD2 3.96Å; R246-L254 HydrophobicContact CG-CD2 3.82Å; R246-L270 WeakPolarHBondContact CD-O 3.42Å; R246-L270 PolarHBondContact NH1-O 2.71Å
247	V	83.1	Confident	85.8	Confident	93 Å²	93	73.5 Å²	73.5	56%	0.564	40%	0.398	S	S	*	.	H	α-helix	trans	-65.3	-44	175.3	170.7	0	0	0	0	110.8	R243 V245 L249 G250	R243-V247 HydrophobicContact CG-CG2 4.07Å; R243-V247 WeakPolarHBondContact O-CB 3.46Å; R243-V247 WeakPolarHBondContact O-CG2 3.48Å; R243-V247 PolarHBondContact O-N 3.32Å; V245-V247 PolarHBondContact O-N 3.2Å; V247-L249 VanDerWaalsContact C-N 3.32Å; V247-L249 PolarHBondContact O-N 2.8Å; V247-G250 PolarHBondContact O-N 3.27Å
248	A	86.6	Confident	86	Confident	76 Å²	76	71.9 Å²	71.9	63%	0.628	39%	0.386	S	S	*	.	H	α-helix	trans	-64.7	-35.1	177.8	0	0	0	0	0	112.9	S244 V245 R253	S244-A248 WeakPolarHBondContact O-CB 3.48Å; S244-A248 PolarHBondContact O-N 3.42Å; V245-A248 PolarHBondContact O-N 2.75Å; A248-R253 PolarHBondContact O-NH2 2.81Å
249	L	86.8	Confident	86.1	Confident	27 Å²	27	75.5 Å²	75.5	14%	0.141	39%	0.393	C	S	.	.	H	α-helix	trans	-70.4	-39.3	172.7	-76.1	159.3	0	0	0	111.9	V245 R246 V247 R253 I257 L260	V245-L249 HydrophobicContact CG1-CD1 3.82Å; V245-L249 WeakPolarHBondContact O-CG 3.46Å; V245-L249 PolarHBondContact O-N 3.46Å; R246-L249 PolarHBondContact O-N 3.31Å; V247-L249 VanDerWaalsContact C-N 3.32Å; V247-L249 PolarHBondContact O-N 2.8Å; L249-R253 PolarHBondContact O-NE 2.75Å; L249-R253 PolarHBondContact O-NH2 3.45Å; L249-I257 HydrophobicContact CD1-CD1 4.2Å; L249-I257 HydrophobicContact CD1-CG1 3.66Å; L249-L260 HydrophobicContact CD1-CD1 4.08Å; L249-L260 HydrophobicContact CD2-CD2 4.45Å
250	G	82.8	Confident	86.4	Confident	29 Å²	29	75.9 Å²	75.9	30%	0.299	40%	0.395	S	S	.	.			trans	78.3	155	-169.2	0	0	0	0	0	111.9	R246 V247 D252 R253	R246-G250 PolarHBondContact O-N 3.01Å; V247-G250 PolarHBondContact O-N 3.27Å; G250-D252 VanDerWaalsContact C-N 3.3Å; G250-D252 PolarHBondContact O-N 2.94Å; G250-R253 PolarHBondContact O-N 3.21Å
251	R	79.2	Confident	86.8	Confident	165 Å²	165	78.3 Å²	78.3	62%	0.623	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-59.6	-37.8	-171.7	-73.4	-177.5	171.1	-179.3	-5.8	113.3	D42 R253 L254	D42-R251 IonicContact OD1-CZ 3.51Å; D42-R251 IonicContact OD1-NE 2.75Å; D42-R251 IonicContact OD1-NH2 3.7Å; D42-R251 PolarHBondContact OD1-NH2 2.93Å; R251-R253 PolarHBondContact O-N 2.91Å; R251-L254 WeakPolarHBondContact O-CG 3.48Å; R251-L254 PolarHBondContact O-N 3.24Å
252	D	82.8	Confident	87	Confident	156 Å²	156	78 Å²	78	83%	0.834	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-67.8	-24.6	-175.8	-53.7	-40.3	0	0	0	113.2	G250	G250-D252 VanDerWaalsContact C-N 3.3Å; G250-D252 PolarHBondContact O-N 2.94Å
253	R	85.9	Confident	87.3	Confident	126 Å²	126	80.6 Å²	80.6	48%	0.475	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-104.3	10.9	-177	-61	-174	-64.1	-179.8	0.8	113.3	A248 L249 G250 R251 S255 E256	A248-R253 PolarHBondContact O-NH2 2.81Å; L249-R253 PolarHBondContact O-NE 2.75Å; L249-R253 PolarHBondContact O-NH2 3.45Å; G250-R253 PolarHBondContact O-N 3.21Å; R251-R253 PolarHBondContact O-N 2.91Å; R253-S255 PolarHBondContact O-N 3.29Å; R253-E256 HydrophobicContact CB-CG 4.41Å; R253-E256 WeakPolarHBondContact O-CA 3.35Å; R253-E256 VanDerWaalsContact O-CB 3.32Å; R253-E256 WeakPolarHBondContact O-CB 3.37Å; R253-E256 PolarHBondContact O-N 2.85Å
254	L	85	Confident	87.7	Confident	30 Å²	30	81.6 Å²	81.6	16%	0.157	45%	0.447	C	S	.	.	G	3₁₀ helix	trans	-62.7	-32.4	177.9	-69.8	173.8	0	0	0	112.2	R246 R251 E256 I257	R246-L254 HydrophobicContact CB-CD2 3.96Å; R246-L254 HydrophobicContact CG-CD2 3.82Å; R251-L254 WeakPolarHBondContact O-CG 3.48Å; R251-L254 PolarHBondContact O-N 3.24Å; L254-E256 PolarHBondContact O-N 3.49Å; L254-I257 HydrophobicContact CB-CD1 4.46Å; L254-I257 HydrophobicContact CD2-CD1 3.92Å; L254-I257 WeakPolarHBondContact O-CB 3.35Å; L254-I257 WeakPolarHBondContact O-CD1 3.47Å; L254-I257 WeakPolarHBondContact O-CG1 3.48Å; L254-I257 PolarHBondContact O-N 2.94Å
255	S	85.1	Confident	87.9	Confident	90 Å²	90	81.8 Å²	81.8	63%	0.629	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-64.3	-21.9	173.1	56.8	0	0	0	0	113	R253 I257	R253-S255 PolarHBondContact O-N 3.29Å; S255-I257 VanDerWaalsContact C-N 3.28Å; S255-I257 PolarHBondContact O-N 3.44Å
256	E	89.3	Confident	88	Confident	77 Å²	77	83.2 Å²	83.2	36%	0.36	45%	0.454	S	S	.	.	G	3₁₀ helix	trans	-81.6	-2.4	177.9	-56.5	-169.1	-141	0	0	113.4	R253 L254 H258 R259	R253-E256 HydrophobicContact CB-CG 4.41Å; R253-E256 WeakPolarHBondContact O-CA 3.35Å; R253-E256 VanDerWaalsContact O-CB 3.32Å; R253-E256 WeakPolarHBondContact O-CB 3.37Å; R253-E256 PolarHBondContact O-N 2.85Å; L254-E256 PolarHBondContact O-N 3.49Å; E256-H258 PolarHBondContact O-N 3.15Å; E256-H258 VanDerWaalsContact O-N 3.09Å; E256-R259 WeakPolarHBondContact O-CA 3.36Å; E256-R259 VanDerWaalsContact O-CB 3.29Å; E256-R259 WeakPolarHBondContact O-CB 3.28Å; E256-R259 PolarHBondContact O-N 3.17Å; E256-R259 IonicContact OE2-NH1 3.45Å
257	I	89.8	Confident	88.2	Confident	0 Å²	0	83.6 Å²	83.6	0%	0	46%	0.456	C	S	.	.	G	3₁₀ helix	trans	-54	-33.5	176.2	-73.3	168.2	0	0	0	111.3	L249 L254 S255 R259 L260 K267 L270 L271	L249-I257 HydrophobicContact CD1-CD1 4.2Å; L249-I257 HydrophobicContact CD1-CG1 3.66Å; L254-I257 HydrophobicContact CB-CD1 4.46Å; L254-I257 HydrophobicContact CD2-CD1 3.92Å; L254-I257 WeakPolarHBondContact O-CB 3.35Å; L254-I257 WeakPolarHBondContact O-CD1 3.47Å; L254-I257 WeakPolarHBondContact O-CG1 3.48Å; L254-I257 PolarHBondContact O-N 2.94Å; S255-I257 VanDerWaalsContact C-N 3.28Å; S255-I257 PolarHBondContact O-N 3.44Å; I257-R259 PolarHBondContact O-N 2.84Å; I257-L260 HydrophobicContact CB-CD1 4.46Å; I257-L260 HydrophobicContact CG1-CD1 4.35Å; I257-L260 HydrophobicContact CG2-CD1 4.38Å; I257-L260 WeakPolarHBondContact O-CB 3.23Å; I257-L260 PolarHBondContact O-N 2.83Å; I257-L260 VanDerWaalsContact O-N 3.11Å; I257-K267 HydrophobicContact CG2-CB 4.12Å; I257-K267 HydrophobicContact CG2-CG 4.21Å; I257-K267 WeakPolarHBondContact O-CE 3.46Å; I257-L270 HydrophobicContact CD1-CB 4.13Å; I257-L270 HydrophobicContact CG2-CB 4.07Å; I257-L270 HydrophobicContact CG2-CD1 4.15Å; I257-L271 HydrophobicContact CB-CD1 4.4Å; I257-L271 HydrophobicContact CB-CD2 4.19Å; I257-L271 HydrophobicContact CB-CG 4.22Å; I257-L271 HydrophobicContact CD1-CD2 3.72Å; I257-L271 HydrophobicContact CD1-CG 4.1Å; I257-L271 HydrophobicContact CG1-CD2 4.48Å; I257-L271 HydrophobicContact CG2-CD1 4.15Å; I257-L271 HydrophobicContact CG2-CG 4.01Å
258	H	88.6	Confident	88.5	Confident	100 Å²	100	82.1 Å²	82.1	46%	0.463	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-61.5	-24.5	175.9	-63.4	-66.7	0	0	0	113.7	E256 K267 L271	E256-H258 PolarHBondContact O-N 3.15Å; E256-H258 VanDerWaalsContact O-N 3.09Å; H258-K267 WeakPolarHBondContact O-CE 3.41Å; H258-K267 PolarHBondContact O-NZ 3.32Å; H258-L271 WeakPolarHBondContact CE1-CD1 3.28Å; H258-L271 WeakPolarHBondContact NE2-CD1 3.47Å
259	R	90.2	Very high	88.7	Confident	199 Å²	199	81.7 Å²	81.7	75%	0.751	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-83.7	-13.8	178.2	-60.6	-178.8	171.6	173.4	-4	113.6	E256 I257	E256-R259 WeakPolarHBondContact O-CA 3.36Å; E256-R259 VanDerWaalsContact O-CB 3.29Å; E256-R259 WeakPolarHBondContact O-CB 3.28Å; E256-R259 PolarHBondContact O-N 3.17Å; E256-R259 IonicContact OE2-NH1 3.45Å; I257-R259 PolarHBondContact O-N 2.84Å
260	L	90.3	Very high	88.8	Confident	46 Å²	46	80.9 Å²	80.9	24%	0.241	42%	0.424	C	S	.	.	S	Bend	trans	-64.2	146.5	179.3	-64.6	174.1	0	0	0	110.8	L249 I257 L262 K267 L270	L249-L260 HydrophobicContact CD1-CD1 4.08Å; L249-L260 HydrophobicContact CD2-CD2 4.45Å; I257-L260 HydrophobicContact CB-CD1 4.46Å; I257-L260 HydrophobicContact CG1-CD1 4.35Å; I257-L260 HydrophobicContact CG2-CD1 4.38Å; I257-L260 WeakPolarHBondContact O-CB 3.23Å; I257-L260 PolarHBondContact O-N 2.83Å; I257-L260 VanDerWaalsContact O-N 3.11Å; L260-L262 HydrophobicContact CB-CB 4.43Å; L260-L262 HydrophobicContact CB-CD1 3.95Å; L260-L262 HydrophobicContact CB-CG 3.96Å; L260-L262 HydrophobicContact CD1-CD1 3.88Å; L260-L262 PolarHBondContact O-N 2.72Å; L260-K267 WeakPolarHBondContact O-CE 3.5Å; L260-K267 PolarHBondContact O-NZ 3.06Å; L260-L270 HydrophobicContact CD1-CD1 4.5Å
261	P	93.3	Very high	89.1	Confident	130 Å²	130	81 Å²	81	84%	0.844	42%	0.417	S	S	*	.	S	Bend	trans	-76	53.8	175.7	34	-36.7	0	0	0	111
262	L	92.9	Very high	89.3	Confident	60 Å²	60	75.9 Å²	75.9	31%	0.314	40%	0.398	S	S	.	.	S	Bend	trans	-118	148.5	-178.1	-63.1	176	0	0	0	110.9	L260 L266 K267 L270	L260-L262 HydrophobicContact CB-CB 4.43Å; L260-L262 HydrophobicContact CB-CD1 3.95Å; L260-L262 HydrophobicContact CB-CG 3.96Å; L260-L262 HydrophobicContact CD1-CD1 3.88Å; L260-L262 PolarHBondContact O-N 2.72Å; L262-L266 HydrophobicContact CB-CB 4.49Å; L262-K267 HydrophobicContact CB-CG 4.18Å; L262-K267 WeakPolarHBondContact O-CE 3.44Å; L262-K267 PolarHBondContact O-NZ 2.74Å; L262-L270 HydrophobicContact CD1-CD1 3.74Å
263	P	95.1	Very high	89.2	Confident	76 Å²	76	76.2 Å²	76.2	49%	0.494	40%	0.395	S	S	.	.			trans	-52.5	149.8	167.8	-25.8	32.5	0	0	0	113.2	S265 L266 K267	P263-S265 VanDerWaalsContact C-N 3.3Å; P263-S265 PolarHBondContact O-N 3.2Å; P263-L266 HydrophobicContact CG-CD1 4.36Å; P263-L266 PolarHBondContact O-N 2.78Å; P263-L266 VanDerWaalsContact O-N 3.11Å; P263-K267 PolarHBondContact O-N 2.84Å; P263-K267 VanDerWaalsContact O-N 3.07Å
264	A	91.5	Very high	89.4	Confident	68 Å²	68	73.7 Å²	73.7	56%	0.562	39%	0.391	S	S	*	.	H	α-helix	trans	-58.2	-39.7	-178.7	0	0	0	0	0	113	L266 K267 N268	A264-L266 VanDerWaalsContact C-N 3.32Å; A264-L266 PolarHBondContact O-N 2.85Å; A264-K267 WeakPolarHBondContact O-CB 3.43Å; A264-K267 PolarHBondContact O-N 2.9Å; A264-N268 VanDerWaalsContact O-CG 3.28Å; A264-N268 PolarHBondContact O-N 3.04Å; A264-N268 PolarHBondContact O-OD1 3.01Å
265	S	91.7	Very high	89.6	Confident	85 Å²	85	76 Å²	76	59%	0.594	40%	0.403	S	S	*	.	H	α-helix	trans	-59.3	-40.8	176.3	51.6	0	0	0	0	112.8	P263 Y269	P263-S265 VanDerWaalsContact C-N 3.3Å; P263-S265 PolarHBondContact O-N 3.2Å; S265-Y269 WeakPolarHBondContact O-CB 3.12Å; S265-Y269 PolarHBondContact O-N 2.96Å
266	L	91.1	Very high	89.8	Confident	84 Å²	84	75.2 Å²	75.2	44%	0.44	39%	0.391	S	S	.	.	H	α-helix	trans	-71.7	-36.6	176.6	-69.6	-177.6	0	0	0	111.9	L262 P263 A264 Y269 L270	L262-L266 HydrophobicContact CB-CB 4.49Å; P263-L266 HydrophobicContact CG-CD1 4.36Å; P263-L266 PolarHBondContact O-N 2.78Å; P263-L266 VanDerWaalsContact O-N 3.11Å; A264-L266 VanDerWaalsContact C-N 3.32Å; A264-L266 PolarHBondContact O-N 2.85Å; L266-Y269 PolarHBondContact O-N 2.98Å; L266-L270 WeakPolarHBondContact O-CB 3.38Å; L266-L270 WeakPolarHBondContact O-CG 3.21Å; L266-L270 PolarHBondContact O-N 2.86Å
267	K	92.1	Very high	89.9	Confident	38 Å²	38	75.1 Å²	75.1	17%	0.165	39%	0.392	C	S	.	.	H	α-helix	trans	-61.1	-46.9	174.1	-70.2	171.4	170.8	174.6	0	111.5	I257 H258 L260 L262 P263 A264 L270 L271	I257-K267 HydrophobicContact CG2-CB 4.12Å; I257-K267 HydrophobicContact CG2-CG 4.21Å; I257-K267 WeakPolarHBondContact O-CE 3.46Å; H258-K267 WeakPolarHBondContact O-CE 3.41Å; H258-K267 PolarHBondContact O-NZ 3.32Å; L260-K267 WeakPolarHBondContact O-CE 3.5Å; L260-K267 PolarHBondContact O-NZ 3.06Å; L262-K267 HydrophobicContact CB-CG 4.18Å; L262-K267 WeakPolarHBondContact O-CE 3.44Å; L262-K267 PolarHBondContact O-NZ 2.74Å; P263-K267 PolarHBondContact O-N 2.84Å; P263-K267 VanDerWaalsContact O-N 3.07Å; A264-K267 WeakPolarHBondContact O-CB 3.43Å; A264-K267 PolarHBondContact O-N 2.9Å; K267-L270 PolarHBondContact O-N 3.16Å; K267-L271 WeakPolarHBondContact O-CB 3.25Å; K267-L271 WeakPolarHBondContact O-CG 3.22Å; K267-L271 PolarHBondContact O-N 2.98Å
268	N	89.6	Confident	89.9	Confident	63 Å²	63	79.8 Å²	79.8	34%	0.337	42%	0.417	S	S	.	.	H	α-helix	trans	-62.4	-46.6	177.7	-68.1	2.1	0	0	0	110.7	A264 L270 L271 Y272 Q273	A264-N268 VanDerWaalsContact O-CG 3.28Å; A264-N268 PolarHBondContact O-N 3.04Å; A264-N268 PolarHBondContact O-OD1 3.01Å; N268-L270 VanDerWaalsContact C-N 3.31Å; N268-L270 PolarHBondContact O-N 3.17Å; N268-L271 CarbonylContact O-C 3.57Å; N268-L271 WeakPolarHBondContact O-CA 3.42Å; N268-L271 PolarHBondContact O-N 2.8Å; N268-Y272 PolarHBondContact O-N 2.92Å; N268-Q273 CarbonylContact C-O 3.59Å; N268-Q273 HydrophobicContact CB-CB 4.16Å; N268-Q273 WeakPolarHBondContact CB-O 3.4Å; N268-Q273 PolarHBondContact O-N 3.05Å
269	Y	89.8	Confident	90	Very high	66 Å²	66	78.5 Å²	78.5	26%	0.259	41%	0.414	S	S	.	.	H	α-helix	trans	-56	-43.3	174.6	178.7	-108.2	0	0	0	113	M238 D239 R242 S265 L266 L271 Y272	M238-Y269 HydrophobicContact CB-CE1 4.19Å; M238-Y269 VanDerWaalsContact CB-OH 3.26Å; M238-Y269 WeakPolarHBondContact CB-OH 3.49Å; M238-Y269 PolarHBondContact O-OH 3.34Å; M238-Y269 VanDerWaalsContact O-OH 3.05Å; D239-Y269 WeakPolarHBondContact CA-OH 3.38Å; D239-Y269 PolarHBondContact N-OH 2.83Å; D239-Y269 VanDerWaalsContact N-OH 3.15Å; D239-Y269 PolarHBondContact OD1-OH 3.03Å; D239-Y269 VanDerWaalsContact OD1-OH 3.13Å; R242-Y269 HydrophobicContact CB-CD1 4.36Å; R242-Y269 HydrophobicContact CB-CE1 3.65Å; R242-Y269 WeakPolarHBondContact CD-O 3.31Å; R242-Y269 HydrophobicContact CG-CE1 4.36Å; S265-Y269 WeakPolarHBondContact O-CB 3.12Å; S265-Y269 PolarHBondContact O-N 2.96Å; L266-Y269 PolarHBondContact O-N 2.98Å; Y269-L271 VanDerWaalsContact C-N 3.26Å; Y269-L271 PolarHBondContact O-N 3.36Å; Y269-Y272 PolarHBondContact O-N 3.27Å
270	L	89.6	Confident	89.9	Confident	11 Å²	11	69.9 Å²	69.9	6%	0.058	39%	0.39	C	S	.	.	H	α-helix	trans	-66.3	-27.1	176.7	-70.4	174.5	0	0	0	113.1	R242 V245 R246 I257 L260 L262 L266 K267 N268	R242-L270 HydrophobicContact CB-CD2 4.1Å; R242-L270 HydrophobicContact CG-CD2 3.98Å; V245-L270 HydrophobicContact CB-CD2 3.92Å; V245-L270 HydrophobicContact CG1-CD1 3.84Å; V245-L270 HydrophobicContact CG1-CD2 3.96Å; V245-L270 HydrophobicContact CG2-CD2 4.4Å; R246-L270 WeakPolarHBondContact CD-O 3.42Å; R246-L270 PolarHBondContact NH1-O 2.71Å; I257-L270 HydrophobicContact CD1-CB 4.13Å; I257-L270 HydrophobicContact CG2-CB 4.07Å; I257-L270 HydrophobicContact CG2-CD1 4.15Å; L260-L270 HydrophobicContact CD1-CD1 4.5Å; L262-L270 HydrophobicContact CD1-CD1 3.74Å; L266-L270 WeakPolarHBondContact O-CB 3.38Å; L266-L270 WeakPolarHBondContact O-CG 3.21Å; L266-L270 PolarHBondContact O-N 2.86Å; K267-L270 PolarHBondContact O-N 3.16Å; N268-L270 VanDerWaalsContact C-N 3.31Å; N268-L270 PolarHBondContact O-N 3.17Å
271	L	87.6	Confident	89.9	Confident	32 Å²	32	71.7 Å²	71.7	17%	0.168	40%	0.401	C	S	.	.	H	α-helix	trans	-93.4	-4.2	-179.6	-72.7	167.4	0	0	0	113.9	I257 H258 K267 N268 Y269 Q273	I257-L271 HydrophobicContact CB-CD1 4.4Å; I257-L271 HydrophobicContact CB-CD2 4.19Å; I257-L271 HydrophobicContact CB-CG 4.22Å; I257-L271 HydrophobicContact CD1-CD2 3.72Å; I257-L271 HydrophobicContact CD1-CG 4.1Å; I257-L271 HydrophobicContact CG1-CD2 4.48Å; I257-L271 HydrophobicContact CG2-CD1 4.15Å; I257-L271 HydrophobicContact CG2-CG 4.01Å; H258-L271 WeakPolarHBondContact CE1-CD1 3.28Å; H258-L271 WeakPolarHBondContact NE2-CD1 3.47Å; K267-L271 WeakPolarHBondContact O-CB 3.25Å; K267-L271 WeakPolarHBondContact O-CG 3.22Å; K267-L271 PolarHBondContact O-N 2.98Å; N268-L271 CarbonylContact O-C 3.57Å; N268-L271 WeakPolarHBondContact O-CA 3.42Å; N268-L271 PolarHBondContact O-N 2.8Å; Y269-L271 VanDerWaalsContact C-N 3.26Å; Y269-L271 PolarHBondContact O-N 3.36Å; L271-Q273 VanDerWaalsContact C-N 3.32Å; L271-Q273 HydrophobicContact CB-CB 4.4Å; L271-Q273 HydrophobicContact CB-CG 3.9Å
272	Y	84.1	Confident	89.6	Confident	56 Å²	56	66.8 Å²	66.8	22%	0.22	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.2	41.1	-168.3	-58.9	-90.7	0	0	0	113	D42 M43 P44 R242 N268 Y269	D42-Y272 VanDerWaalsContact O-CE2 3.26Å; D42-Y272 WeakPolarHBondContact O-CE2 3.49Å; M43-Y272 HydrophobicContact CB-CE1 4.42Å; M43-Y272 HydrophobicContact CG-CE1 4.03Å; P44-Y272 VanDerWaalsContact CD-CD1 3.41Å; P44-Y272 VanDerWaalsContact CD-CG 3.46Å; P44-Y272 VanDerWaalsContact CG-CB 3.44Å; P44-Y272 HydrophobicContact CG-CD1 3.93Å; P44-Y272 HydrophobicContact CG-CD2 4.23Å; P44-Y272 HydrophobicContact CG-CG 3.66Å; R242-Y272 VanDerWaalsContact CZ-CZ 3.47Å; R242-Y272 VanDerWaalsContact NE-CZ 3.34Å; R242-Y272 PolarHBondContact NE-OH 2.94Å; N268-Y272 PolarHBondContact O-N 2.92Å; Y269-Y272 PolarHBondContact O-N 3.27Å
273	Q	80.8	Confident	89.3	Confident	163 Å²	163	67.5 Å²	67.5	76%	0.762	37%	0.369	S	S	*	.			trans	-113.3	0	177.2	-66.4	177.2	-9.2	0	0	111.5	N268 L271	N268-Q273 CarbonylContact C-O 3.59Å; N268-Q273 HydrophobicContact CB-CB 4.16Å; N268-Q273 WeakPolarHBondContact CB-O 3.4Å; N268-Q273 PolarHBondContact O-N 3.05Å; L271-Q273 VanDerWaalsContact C-N 3.32Å; L271-Q273 HydrophobicContact CB-CB 4.4Å; L271-Q273 HydrophobicContact CB-CG 3.9Å

Retrieved 273 of 273 residues in 127.6 ms (Link to these results)

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